(* Content-type: application/vnd.wolfram.mathematica *) (*** Wolfram Notebook File ***) (* http://www.wolfram.com/nb *) (* CreatedBy='Mathematica 9.0' *) (*CacheID: 234*) (* Internal cache information: NotebookFileLineBreakTest NotebookFileLineBreakTest NotebookDataPosition[ 157, 7] NotebookDataLength[ 200772, 4513] NotebookOptionsPosition[ 194515, 4311] NotebookOutlinePosition[ 195015, 4331] CellTagsIndexPosition[ 194972, 4328] WindowFrame->Normal*) (* Beginning of Notebook Content *) Notebook[{ Cell[BoxData[ RowBox[{ RowBox[{"(*", " ", RowBox[{ RowBox[{ "Kimball", " ", "model", " ", "and", " ", "energy", " ", "derived", " ", "from", " ", "Wolfram", " ", "source"}], ",", " ", RowBox[{"ES", " ", "27", " ", "February", " ", "2013"}]}], " ", "*)"}], " ", "\[IndentingNewLine]", RowBox[{ RowBox[{"Clear", "[", RowBox[{ "tw", ",", "n2", ",", "n", ",", "nb", ",", "bc", ",", "bh", ",", "u", ",", "u1", ",", "u2", ",", "Vee", ",", "Vne", ",", "Vnn"}], "]"}], ";"}]}]], "Input", CellChangeTimes->{{3.568278170270548*^9, 3.568278174310955*^9}, { 3.5682782109554195`*^9, 3.5682782183342323`*^9}, {3.5688220426984916`*^9, 3.5688220506389055`*^9}, {3.568822092353379*^9, 3.568822134660653*^9}, { 3.5688728241768503`*^9, 3.568872825034852*^9}, {3.5688958900531473`*^9, 3.5688958965115585`*^9}, {3.5689027504159966`*^9, 3.568902751695199*^9}, { 3.5689109808408637`*^9, 3.568910992618884*^9}, {3.569134574760273*^9, 3.569134584135889*^9}, 3.56923802266416*^9, {3.56933446475942*^9, 3.569334471239791*^9}, {3.5693395229642725`*^9, 3.569339531606688*^9}, { 3.5694332905109916`*^9, 3.56943330667262*^9}, {3.570297588441428*^9, 3.5702976026530533`*^9}, {3.570558862041448*^9, 3.5705588713234644`*^9}, 3.5705590387585583`*^9, {3.570855141170933*^9, 3.570855146100541*^9}, { 3.5708563212974052`*^9, 3.5708563224362073`*^9}, {3.5708588179101906`*^9, 3.570858820452995*^9}, 3.570949483910489*^9}], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{ RowBox[{"ChemicalData", "[", RowBox[{"\"\\"", ",", "\"\\""}], "]"}], "\[IndentingNewLine]"}]], "Input", CellChangeTimes->{{3.570856547809803*^9, 3.5708565502590075`*^9}, 3.5708567094884872`*^9, 3.5709425310070767`*^9, {3.571043490110433*^9, 3.5710434917172356`*^9}, 3.571043529531702*^9, 3.5710448378904*^9, 3.5710449557330074`*^9}], Cell[BoxData[ Graphics3DBox[ {AbsoluteThickness[3], EdgeForm[None], Specularity[ GrayLevel[1], 100], GraphicsComplex3DBox[CompressedData[" 1:eJwB2QEm/iFib1JlAgAAABMAAAADAAAAJCh+jLnrJcCu2F92T95FwH6MuWsJ sUbAlkOLbOcrW8AdIJijx48TwCcxCKwcMlBAYOXQIts5XUALJCh+jNlCQFYO LbKdvz7A78nDQq1pTMDwhclUwSg3wNnO91PjFWLA0ZFc/kO6KUBiEFg5tARj wCS5/If0o0LAoWez6nNdT8A5tMh2vn85wHe+nxovgWRAvp8aL91EacAf9GxW fRZQwBHHuriNBktAw/UoXI+SYMBEi2zn++FZQF+YTBWMYkxA+FPjpZuMZ0Ck x+9t+sMiQEw3iUFgzVvAEoPAyqFZZEAyVTAqqRMxQOf7qfHSIVFAyjLEsS4+ V0BeukkMAkNiQLyWkA96bkPA/Knx0k3yQMDTTWIQWLlAwPgx5q4lwlfAYE3z jlN07j+OBvAWSHxYwNEi2/l+qkTAs3vysFBtVcBAvK5fsGMuwArXo3A9mlxA xCCwcmhtY8AhdqbQeU9BwLCUZYhjtU1AjpduEoMoXsBCCTNt/6hIQFZ9rrZi Y05AVOOlm8QUY0D0FaQZi4o3QHA9CtejvlHA4XoUrkd7YUCkTkATYWM7QKJw PQrX4zJAFYxK6gQ8WkBgw9MrZflWQPSOU3QkZ0HAhq3cZw== "], { {RGBColor[0.65, 0.7, 0.7], SphereBox[4, 24.], SphereBox[5, 24.], SphereBox[6, 24.], SphereBox[7, 24.], SphereBox[8, 24.], SphereBox[9, 24.], SphereBox[10, 24.], SphereBox[11, 24.]}, {RGBColor[0.4, 0.4, 0.4], SphereBox[1, 34.], SphereBox[2, 34.], SphereBox[3, 34.]}, {RGBColor[0.65, 0.7, 0.7], CylinderBox[{12, 4}, 15.], CylinderBox[{13, 5}, 15.], CylinderBox[{14, 6}, 15.], CylinderBox[{15, 7}, 15.], CylinderBox[{16, 8}, 15.], CylinderBox[{17, 9}, 15.], CylinderBox[{18, 10}, 15.], CylinderBox[{19, 11}, 15.]}, {RGBColor[0.4, 0.4, 0.4], CylinderBox[{1, 2}, 15.], CylinderBox[{1, 3}, 15.], CylinderBox[{1, 12}, 15.], CylinderBox[{1, 13}, 15.], CylinderBox[{2, 14}, 15.], CylinderBox[{2, 15}, 15.], CylinderBox[{2, 16}, 15.], CylinderBox[{3, 17}, 15.], CylinderBox[{3, 18}, 15.], CylinderBox[{3, 19}, 15.]}}]}, Boxed->False, ImageSize->165.53956236958737`, Lighting->"Neutral", ViewPoint->{1.3, -2.4, -2.}]], "Output", CellChangeTimes->{3.5710449973070803`*^9, 3.5802161038873343`*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[{ RowBox[{ RowBox[{"t1", "=", RowBox[{"0.01889726", "*", RowBox[{"ChemicalData", "[", RowBox[{"\"\\"", ",", "\"\\""}], "]"}]}]}], ";"}], "\n", RowBox[{"MatrixForm", "[", "t1", "]"}]}], "Input", CellChangeTimes->{ 3.57029749846047*^9, {3.570297893562364*^9, 3.5702979152152023`*^9}, { 3.5704535321223855`*^9, 3.570453555038826*^9}, {3.570558892227501*^9, 3.5705589112283344`*^9}, {3.5705589864360666`*^9, 3.5705590132681136`*^9}, {3.5705590525489826`*^9, 3.5705590747322216`*^9}, {3.570595322227199*^9, 3.5705953504632483`*^9}, 3.570855059411189*^9, 3.570856566545436*^9, 3.5709425310226765`*^9, 3.5710435245240936`*^9, 3.571044837906*^9, 3.571044955748607*^9}], Cell[BoxData[ TagBox[ RowBox[{"(", "\[NoBreak]", GridBox[{ { RowBox[{"-", "0.20712152850399998`"}], RowBox[{"-", "0.826505681168`"}], RowBox[{"-", "0.8576162403059999`"}]}, { RowBox[{"-", "2.05386760036`"}], RowBox[{"-", "0.0924153492766`"}], "1.22422119458`"}, {"2.20916528304`", "0.7124191430959999`", RowBox[{"-", "0.58106239911`"}]}, { RowBox[{"-", "1.073848137856`"}], RowBox[{"-", "0.43764542379199994`"}], RowBox[{"-", "2.7341311658399996`"}]}, {"0.24309057318799998`", RowBox[{"-", "2.8751614172199997`"}], RowBox[{"-", "0.704506860334`"}]}, { RowBox[{"-", "1.185427009526`"}], RowBox[{"-", "0.48186123274`"}], "3.09984983862`"}, { RowBox[{"-", "3.8201189035199996`"}], RowBox[{"-", "1.2160651371639999`"}], "1.021419579712`"}, { RowBox[{"-", "2.5053987308`"}], "1.95645222506`", "1.072795560474`"}, {"3.56013040044`", "0.1773086442102`", RowBox[{"-", "2.10154538734`"}]}, {"3.0764928252599995`", "0.32270472956799995`", "1.2950008819099998`"}, {"1.756908497816`", "2.7607763024399996`", RowBox[{"-", "0.734406105106`"}]} }, GridBoxAlignment->{ "Columns" -> {{Center}}, "ColumnsIndexed" -> {}, "Rows" -> {{Baseline}}, "RowsIndexed" -> {}}, GridBoxSpacings->{"Columns" -> { Offset[0.27999999999999997`], { Offset[0.7]}, Offset[0.27999999999999997`]}, "ColumnsIndexed" -> {}, "Rows" -> { Offset[0.2], { Offset[0.4]}, Offset[0.2]}, "RowsIndexed" -> {}}], "\[NoBreak]", ")"}], Function[BoxForm`e$, MatrixForm[BoxForm`e$]]]], "Output", CellChangeTimes->{3.5710449973382807`*^9, 3.580216103902934*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{"u", "=", RowBox[{"ChemicalData", "\[NoBreak]", "[", RowBox[{"\"\\"", ",", "\"\\""}], "]"}]}]], "Input", CellChangeTimes->{ 3.57029749846047*^9, {3.570297893562364*^9, 3.5702979152152023`*^9}, { 3.5704535321223855`*^9, 3.570453555038826*^9}, {3.570558892227501*^9, 3.5705589112283344`*^9}, {3.5705589864360666`*^9, 3.5705590132681136`*^9}, 3.5705592408949137`*^9, {3.5705593512807074`*^9, 3.5705593890483737`*^9}, { 3.570559442712468*^9, 3.5705594826641383`*^9}, 3.5708550837628317`*^9, 3.570856587480673*^9, 3.5709425310226765`*^9, 3.5710435245552936`*^9, 3.5710448379216003`*^9, 3.571044955764207*^9}], Cell[BoxData[ RowBox[{"{", RowBox[{"\<\"C\"\>", ",", "\<\"C\"\>", ",", "\<\"C\"\>", ",", "\<\"H\"\>", ",", "\<\"H\"\>", ",", "\<\"H\"\>", ",", "\<\"H\"\>", ",", "\<\"H\"\>", ",", "\<\"H\"\>", ",", "\<\"H\"\>", ",", "\<\"H\"\>"}], "}"}]], "Output", CellChangeTimes->{3.5710449973538804`*^9, 3.5802161039185343`*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{"n", "=", RowBox[{"Length", "[", "t1", "]"}]}]], "Input", CellChangeTimes->{{3.568278170270548*^9, 3.568278174310955*^9}, { 3.5682782109554195`*^9, 3.5682782183342323`*^9}, {3.5688220426984916`*^9, 3.5688220506389055`*^9}, {3.568822092353379*^9, 3.568822123693834*^9}, 3.568873215924739*^9, 3.5689108676002645`*^9, 3.5689997098237543`*^9, 3.5689998170115423`*^9, 3.568999886915265*^9, 3.5691460425981283`*^9, { 3.5692371678918586`*^9, 3.569237204489523*^9}, 3.569237465805582*^9, 3.56923802261736*^9, 3.5693403424025126`*^9, 3.5693404501675014`*^9, 3.569340737988007*^9, 3.569340852819809*^9, 3.569341165475558*^9, 3.56934149694494*^9, 3.569342614390503*^9, 3.569343567162176*^9, 3.569343662712344*^9, 3.569343763597721*^9, 3.5693440703198595`*^9, 3.569344266209404*^9, 3.5702973471714044`*^9, 3.5702974395391665`*^9, { 3.570297637207114*^9, 3.570297637987115*^9}, 3.570297920051211*^9}], Cell[BoxData["11"], "Output", CellChangeTimes->{3.57104499736948*^9, 3.5802161039341345`*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{"un", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", "\"\\""}], ",", "\"\\"", ",", RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}]}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}]}], "]"}]}]], "Input", CellChangeTimes->{{3.568807971988578*^9, 3.5688080897687845`*^9}, { 3.5688081769573374`*^9, 3.5688081865669546`*^9}, {3.568808274317109*^9, 3.5688082853151283`*^9}, {3.5688085365847692`*^9, 3.568808578330443*^9}, { 3.568808822704872*^9, 3.5688088761037655`*^9}, {3.56880890727262*^9, 3.568808937365073*^9}, {3.568809097608555*^9, 3.5688091594002633`*^9}, 3.5688092418308077`*^9, {3.5688092753552666`*^9, 3.568809302577315*^9}, { 3.5688096257786827`*^9, 3.568809703201618*^9}, {3.5688097456336927`*^9, 3.568809788268568*^9}, 3.568809850575077*^9, {3.568809946562046*^9, 3.5688099535664577`*^9}, {3.5688100003197403`*^9, 3.568810008556555*^9}, { 3.568810075371472*^9, 3.56881007981748*^9}, {3.568813431920168*^9, 3.568813533086345*^9}, {3.5688135960324554`*^9, 3.5688136045344706`*^9}, { 3.5688136407889347`*^9, 3.568813707494652*^9}, {3.568813812529636*^9, 3.5688138275524626`*^9}, {3.5688140611940727`*^9, 3.568814062738476*^9}, { 3.568814121113778*^9, 3.5688141965555105`*^9}, {3.568814326675339*^9, 3.568814331074547*^9}, 3.568814589473401*^9, 3.5688146762563534`*^9, 3.56881472549004*^9}], Cell[BoxData[ RowBox[{"{", RowBox[{"\<\"C\"\>", ",", "\<\"C\"\>", ",", "\<\"C\"\>", ",", "\<\"Z\"\>", ",", "\<\"Z\"\>", ",", "\<\"Z\"\>", ",", "\<\"Z\"\>", ",", "\<\"Z\"\>", ",", "\<\"Z\"\>", ",", "\<\"Z\"\>", ",", "\<\"Z\"\>"}], "}"}]], "Output", CellChangeTimes->{3.5710449973850803`*^9, 3.5802161039497347`*^9}] }, Open ]], Cell[BoxData[ RowBox[{ RowBox[{"num", "=", RowBox[{"Table", "[", RowBox[{"i", ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}]}], "]"}]}], ";"}]], "Input", CellChangeTimes->{{3.568807971988578*^9, 3.5688080897687845`*^9}, { 3.5688081769573374`*^9, 3.5688081865669546`*^9}, {3.568808274317109*^9, 3.5688082853151283`*^9}, {3.5688085365847692`*^9, 3.568808578330443*^9}, { 3.568808822704872*^9, 3.5688088761037655`*^9}, {3.56880890727262*^9, 3.568808937365073*^9}, {3.568809097608555*^9, 3.5688091594002633`*^9}, 3.5688092418308077`*^9, {3.5688092753552666`*^9, 3.568809302577315*^9}, { 3.5688096257786827`*^9, 3.568809703201618*^9}, {3.5688097456336927`*^9, 3.568809788268568*^9}, 3.568809850575077*^9, {3.568809946562046*^9, 3.5688099535664577`*^9}, {3.5688100003197403`*^9, 3.568810008556555*^9}, { 3.568810075371472*^9, 3.56881007981748*^9}, {3.568813431920168*^9, 3.568813533086345*^9}, {3.5688135960324554`*^9, 3.5688136045344706`*^9}, { 3.5688136407889347`*^9, 3.568813707494652*^9}, {3.568813812529636*^9, 3.5688138275524626`*^9}, {3.5688140611940727`*^9, 3.568814062738476*^9}, { 3.568814121113778*^9, 3.5688141965555105`*^9}, {3.568814326675339*^9, 3.568814331074547*^9}, 3.568814589473401*^9, {3.5688146762563534`*^9, 3.5688146829331646`*^9}, 3.5688147231032352`*^9, 3.5688216336189733`*^9}], Cell[BoxData[ RowBox[{ RowBox[{"um", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"{", RowBox[{ RowBox[{"un", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"num", "[", RowBox[{"[", "i", "]"}], "]"}]}], "}"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}]}], "]"}]}], ";"}]], "Input", CellChangeTimes->{{3.568807971988578*^9, 3.5688080897687845`*^9}, { 3.5688081769573374`*^9, 3.5688081865669546`*^9}, {3.568808274317109*^9, 3.5688082853151283`*^9}, {3.5688085365847692`*^9, 3.568808578330443*^9}, { 3.568808822704872*^9, 3.5688088761037655`*^9}, {3.56880890727262*^9, 3.568808937365073*^9}, {3.568809097608555*^9, 3.5688091594002633`*^9}, 3.5688092418308077`*^9, {3.5688092753552666`*^9, 3.568809302577315*^9}, { 3.5688096257786827`*^9, 3.568809703201618*^9}, {3.5688097456336927`*^9, 3.568809788268568*^9}, 3.568809850575077*^9, {3.568809946562046*^9, 3.5688099535664577`*^9}, {3.5688100003197403`*^9, 3.568810008556555*^9}, { 3.568810075371472*^9, 3.56881007981748*^9}, {3.568813431920168*^9, 3.568813533086345*^9}, {3.5688135960324554`*^9, 3.5688136045344706`*^9}, { 3.5688136407889347`*^9, 3.568813707494652*^9}, {3.568813812529636*^9, 3.5688138275524626`*^9}, {3.5688140611940727`*^9, 3.568814062738476*^9}, { 3.568814121113778*^9, 3.5688141965555105`*^9}, {3.568814326675339*^9, 3.568814331074547*^9}, 3.568814589473401*^9, {3.5688146762563534`*^9, 3.5688146885023746`*^9}, 3.5688147203576307`*^9, 3.56882164316619*^9}], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{"us", "=", RowBox[{"Sort", "[", "um", "]"}]}]], "Input", CellChangeTimes->{{3.568807971988578*^9, 3.5688080897687845`*^9}, { 3.5688081769573374`*^9, 3.5688081865669546`*^9}, {3.568808274317109*^9, 3.5688082853151283`*^9}, {3.5688085365847692`*^9, 3.568808578330443*^9}, { 3.568808822704872*^9, 3.5688088761037655`*^9}, {3.56880890727262*^9, 3.568808937365073*^9}, {3.568809097608555*^9, 3.5688091594002633`*^9}, 3.5688092418308077`*^9, {3.5688092753552666`*^9, 3.568809302577315*^9}, { 3.5688096257786827`*^9, 3.568809703201618*^9}, {3.5688097456336927`*^9, 3.568809788268568*^9}, 3.568809850575077*^9, {3.568809946562046*^9, 3.5688099535664577`*^9}, {3.5688100003197403`*^9, 3.568810008556555*^9}, { 3.568810075371472*^9, 3.56881007981748*^9}, {3.568813431920168*^9, 3.568813533086345*^9}, {3.5688135960324554`*^9, 3.5688136045344706`*^9}, { 3.5688136407889347`*^9, 3.568813707494652*^9}, {3.568813812529636*^9, 3.5688138275524626`*^9}, {3.5688140611940727`*^9, 3.568814062738476*^9}, { 3.568814121113778*^9, 3.5688141965555105`*^9}, {3.568814326675339*^9, 3.568814331074547*^9}, 3.568814589473401*^9, {3.5688146762563534`*^9, 3.5688146945707855`*^9}}], Cell[BoxData[ RowBox[{"{", RowBox[{ RowBox[{"{", RowBox[{"\<\"C\"\>", ",", "1"}], "}"}], ",", RowBox[{"{", RowBox[{"\<\"C\"\>", ",", "2"}], "}"}], ",", RowBox[{"{", RowBox[{"\<\"C\"\>", ",", "3"}], "}"}], ",", RowBox[{"{", RowBox[{"\<\"Z\"\>", ",", "4"}], "}"}], ",", RowBox[{"{", RowBox[{"\<\"Z\"\>", ",", "5"}], "}"}], ",", RowBox[{"{", RowBox[{"\<\"Z\"\>", ",", "6"}], "}"}], ",", RowBox[{"{", RowBox[{"\<\"Z\"\>", ",", "7"}], "}"}], ",", RowBox[{"{", RowBox[{"\<\"Z\"\>", ",", "8"}], "}"}], ",", RowBox[{"{", RowBox[{"\<\"Z\"\>", ",", "9"}], "}"}], ",", RowBox[{"{", RowBox[{"\<\"Z\"\>", ",", "10"}], "}"}], ",", RowBox[{"{", RowBox[{"\<\"Z\"\>", ",", "11"}], "}"}]}], "}"}]], "Output", CellChangeTimes->{3.5710449974162807`*^9, 3.5802161039653344`*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{"num", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"us", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}]}], "]"}]}]], "Input", CellChangeTimes->{{3.56881016518083*^9, 3.5688102745058217`*^9}, { 3.5688103430679426`*^9, 3.5688103543155622`*^9}, {3.5688124958093233`*^9, 3.568812496386524*^9}, {3.5688126345871673`*^9, 3.568812635491969*^9}, { 3.568812673025635*^9, 3.5688126732128353`*^9}, {3.5688127492161684`*^9, 3.568812848541543*^9}, 3.5688129280080824`*^9, {3.568813062152718*^9, 3.5688131360032477`*^9}, 3.568813172678912*^9, 3.568821701869093*^9}], Cell[BoxData[ RowBox[{"{", RowBox[{ "1", ",", "2", ",", "3", ",", "4", ",", "5", ",", "6", ",", "7", ",", "8", ",", "9", ",", "10", ",", "11"}], "}"}]], "Output", CellChangeTimes->{3.5710449974318805`*^9, 3.580216103980934*^9}] }, Open ]], Cell[BoxData[ RowBox[{ RowBox[{"For", "[", RowBox[{ RowBox[{"i", "=", "1"}], ",", RowBox[{"i", "<", RowBox[{"n", "+", "1"}]}], ",", RowBox[{"i", "++"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"us", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "\[Equal]", "\"\\""}], ",", RowBox[{ RowBox[{"us", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "=", "\"\\""}]}], "]"}]}], "]"}], ";"}]], "Input", CellChangeTimes->{{3.568277663590458*^9, 3.568277712652544*^9}, 3.5682785838808746`*^9, {3.56880682872497*^9, 3.568806862015428*^9}, 3.5688069650848093`*^9, 3.568807273668951*^9, 3.5688073087846127`*^9, { 3.568807384553946*^9, 3.5688073893119545`*^9}, {3.56881489654434*^9, 3.5688149048591547`*^9}, {3.568821714349115*^9, 3.568821718951123*^9}}], Cell[CellGroupData[{ Cell[BoxData[{ RowBox[{"u1", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"us", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "\[Equal]", "\"\\""}], ",", "0.255", ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"us", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "\[Equal]", "\"\\""}], ",", "0.1", ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"us", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "\[Equal]", "\"\\""}], ",", "0.24", ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"us", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "\[Equal]", "\"\\""}], ",", "0.178", ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"us", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "\[Equal]", "\"\\""}], ",", "0.5"}], "]"}]}], "]"}]}], "]"}]}], "]"}]}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}]}], "]"}]}], "\[IndentingNewLine]", RowBox[{"u2", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"us", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "\[Equal]", "\"\\""}], ",", "0.2557", ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"us", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "\[Equal]", "\"\\""}], ",", "0.6", ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"us", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "\[Equal]", "\"\\""}], ",", "0.22522", ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"us", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "\[Equal]", "\"\\""}], ",", "0.178", ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"us", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "\[Equal]", "\"\\""}], ",", "0.5"}], "]"}]}], "]"}]}], "]"}]}], "]"}]}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}]}], "]"}]}]}], "Input", CellChangeTimes->{{3.5679480369450207`*^9, 3.567948069112277*^9}, { 3.5679486805553513`*^9, 3.5679487948723516`*^9}, 3.567950206581231*^9, { 3.5681216077716007`*^9, 3.5681216839309344`*^9}, {3.568266380090639*^9, 3.5682664108850937`*^9}, {3.568266481350417*^9, 3.56826649971165*^9}, 3.5682795170433135`*^9, {3.5682795636873956`*^9, 3.5682797843809834`*^9}, { 3.568279837187076*^9, 3.5682798459854913`*^9}, {3.568279877201146*^9, 3.568279880711152*^9}, {3.5682799570264864`*^9, 3.5682799599124913`*^9}, { 3.5683770044498715`*^9, 3.5683771523693314`*^9}, 3.5688133425788107`*^9, { 3.568814931192001*^9, 3.5688150075073347`*^9}, {3.5688765350957685`*^9, 3.5688765981198792`*^9}, {3.568876634452343*^9, 3.5688766352167444`*^9}, { 3.568894358551657*^9, 3.5688944054453397`*^9}, {3.568894522929146*^9, 3.5688945259087515`*^9}, {3.5688946101644993`*^9, 3.5688946171221113`*^9}, {3.568894651067771*^9, 3.568894651956972*^9}, 3.5688946827982264`*^9, {3.568894734527918*^9, 3.568894735495119*^9}, { 3.5688947726699843`*^9, 3.568894773496786*^9}, {3.5688948078948464`*^9, 3.568895097914956*^9}, {3.5689558039020233`*^9, 3.568955804619624*^9}, { 3.5689559169086213`*^9, 3.5689559179070234`*^9}, {3.5689559496998787`*^9, 3.568955950589081*^9}, {3.568956090817727*^9, 3.568956118273775*^9}, 3.5689561556982408`*^9, {3.5690814230317364`*^9, 3.5690814238897376`*^9}, { 3.569232478412421*^9, 3.5692324795356236`*^9}, {3.5692325096124763`*^9, 3.5692325115780797`*^9}, {3.5692325933846235`*^9, 3.569232594289425*^9}, { 3.569235467676072*^9, 3.5692354683780737`*^9}, {3.5692358857568064`*^9, 3.5692358867552085`*^9}, {3.569236173312112*^9, 3.569236174060913*^9}, { 3.569344745239445*^9, 3.569344781213108*^9}, {3.5693896312339673`*^9, 3.5693896351495743`*^9}, {3.5693896840088596`*^9, 3.5693896981112843`*^9}, {3.5693897680462074`*^9, 3.5693897743798184`*^9}, 3.570595843597315*^9, 3.5705958765133724`*^9, {3.5706006955110383`*^9, 3.57060069660304*^9}, {3.570600739659116*^9, 3.5706007402207165`*^9}, { 3.5706007784563837`*^9, 3.5706008313872766`*^9}, {3.5706008641161346`*^9, 3.5706008892321787`*^9}, 3.5706010214580107`*^9, {3.5706011135917726`*^9, 3.570601115058175*^9}, {3.5706011509850388`*^9, 3.5706011750714808`*^9}, { 3.5706012352719865`*^9, 3.570601260746831*^9}, 3.570856110868636*^9, 3.570856144034294*^9, 3.5708561753903494`*^9, {3.5708562115824127`*^9, 3.570856236261656*^9}, 3.5708568877188005`*^9, 3.570856960992129*^9, { 3.5708570022854013`*^9, 3.570857003424204*^9}, 3.5708574863854513`*^9, 3.570857676003785*^9, {3.570857720697863*^9, 3.570857774736358*^9}, { 3.570857815015629*^9, 3.570857815265229*^9}, {3.5708578488052883`*^9, 3.5708579513754683`*^9}, {3.5708579844319267`*^9, 3.570858009937971*^9}, { 3.5708583084132957`*^9, 3.570858421435494*^9}}], Cell[BoxData[ RowBox[{"{", RowBox[{ "0.255`", ",", "0.255`", ",", "0.255`", ",", "0.1`", ",", "0.1`", ",", "0.1`", ",", "0.1`", ",", "0.1`", ",", "0.1`", ",", "0.1`", ",", "0.1`"}], "}"}]], "Output", CellChangeTimes->{3.57104499744748*^9, 3.5802161039965343`*^9}], Cell[BoxData[ RowBox[{"{", RowBox[{ "0.2557`", ",", "0.2557`", ",", "0.2557`", ",", "0.6`", ",", "0.6`", ",", "0.6`", ",", "0.6`", ",", "0.6`", ",", "0.6`", ",", "0.6`", ",", "0.6`"}], "}"}]], "Output", CellChangeTimes->{3.57104499744748*^9, 3.5802161039965343`*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{"u", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"us", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}]}], "]"}]}]], "Input", CellChangeTimes->{{3.5679472243083935`*^9, 3.567947394894693*^9}, { 3.567947453425996*^9, 3.567947471241227*^9}, {3.5679475415037503`*^9, 3.5679475448733563`*^9}, {3.5679488138107853`*^9, 3.567948820877598*^9}, { 3.568820296244224*^9, 3.5688203477867146`*^9}}], Cell[BoxData[ RowBox[{"{", RowBox[{"\<\"C\"\>", ",", "\<\"C\"\>", ",", "\<\"C\"\>", ",", "\<\"H\"\>", ",", "\<\"H\"\>", ",", "\<\"H\"\>", ",", "\<\"H\"\>", ",", "\<\"H\"\>", ",", "\<\"H\"\>", ",", "\<\"H\"\>", ",", "\<\"H\"\>"}], "}"}]], "Output", CellChangeTimes->{3.5710449974630804`*^9, 3.5802161040121346`*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{"cn", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", "\"\\""}], ",", "6.0", ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", "\"\\""}], ",", "1.0", ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", "\"\\""}], ",", "7.0", ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", "\"\\""}], ",", "8.0", ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", "\"\\""}], ",", "17.0"}], "]"}]}], "]"}]}], "]"}]}], "]"}]}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}]}], "]"}]}]], "Input", CellChangeTimes->{{3.5688224161787477`*^9, 3.5688224173799496`*^9}, { 3.5688224905908785`*^9, 3.568822500434496*^9}, 3.5692358293003073`*^9, 3.5692358676919746`*^9, {3.569344570581538*^9, 3.5693446110324097`*^9}}], Cell[BoxData[ RowBox[{"{", RowBox[{ "6.`", ",", "6.`", ",", "6.`", ",", "1.`", ",", "1.`", ",", "1.`", ",", "1.`", ",", "1.`", ",", "1.`", ",", "1.`", ",", "1.`"}], "}"}]], "Output", CellChangeTimes->{3.5710449974786806`*^9, 3.5802161040277348`*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[{ RowBox[{ RowBox[{"bc", "=", "0"}], ";"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"For", "[", RowBox[{ RowBox[{"i", "=", "1"}], ",", " ", RowBox[{"i", "<", RowBox[{"n", "+", "1"}]}], ",", RowBox[{"i", "++"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}], "\[NotEqual]", "\"\\""}], ",", " ", RowBox[{"bc", "=", RowBox[{"bc", "+", "1"}]}]}], "]"}]}], "]"}], ";"}], "\[IndentingNewLine]", "bc", "\[IndentingNewLine]", RowBox[{"bh", "=", RowBox[{"n", "-", "bc"}]}]}], "Input", CellChangeTimes->{{3.5688281182607965`*^9, 3.5688281434392405`*^9}, { 3.5691376772313223`*^9, 3.569137733516221*^9}, {3.569234042049968*^9, 3.569234051519184*^9}, 3.5692372799312553`*^9}], Cell[BoxData["3"], "Output", CellChangeTimes->{3.5710449974942803`*^9, 3.5802161040277348`*^9}], Cell[BoxData["8"], "Output", CellChangeTimes->{3.5710449974942803`*^9, 3.5802161040277348`*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{ RowBox[{"ChemicalData", "\[NoBreak]", "[", RowBox[{"\"\\"", ",", "\"\\""}], "]"}], "\[IndentingNewLine]"}]], "Input", CellChangeTimes->{{3.5708566311295495`*^9, 3.5708566338907547`*^9}, 3.5709425310382767`*^9, 3.5710435245552936`*^9, 3.5710448379216003`*^9, 3.571044955764207*^9}], Cell[BoxData["\<\"CH3CH2CH3\"\>"], "Output", CellChangeTimes->{3.5710449975098805`*^9, 3.5802161040433345`*^9}] }, Open ]], Cell[BoxData[{ RowBox[{ RowBox[{"DeleteFile", "[", " ", "\"\\"", "]"}], ";"}], "\[IndentingNewLine]", RowBox[{"For", "[", RowBox[{ RowBox[{"i", "=", "1"}], ",", RowBox[{"i", "<", RowBox[{"n", "+", "1"}]}], ",", RowBox[{"i", "++"}], ",", "\[IndentingNewLine]", RowBox[{ RowBox[{"{", RowBox[{ RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"Extract", "[", RowBox[{"t1", ",", RowBox[{"{", "i", "}"}]}], "]"}]}], "}"}], ">>>", " ", "\"\\""}]}], "]"}]}], "Input", CellChangeTimes->{{3.567869377256353*^9, 3.5678694101568108`*^9}, { 3.5678695244894114`*^9, 3.56786953511303*^9}, 3.56786988243204*^9, 3.5678699252853155`*^9, {3.567870069179968*^9, 3.5678700766835814`*^9}, { 3.5678703216664114`*^9, 3.567870325738019*^9}, 3.5679271251072817`*^9, { 3.567942840466694*^9, 3.567942854381918*^9}, {3.567942932272855*^9, 3.567942950509287*^9}, 3.5679430681802936`*^9, {3.568278272060727*^9, 3.56827827391713*^9}, 3.5688732159559383`*^9, 3.568910867631465*^9, 3.5689997098549547`*^9, 3.5689998170427427`*^9, 3.5689998869620657`*^9, { 3.569059200815255*^9, 3.5690592031552596`*^9}, 3.5691460426137285`*^9, 3.569237204520723*^9, 3.569237465836782*^9, 3.56923802264856*^9, 3.5693403424181123`*^9, 3.569340450198702*^9, 3.569340738019207*^9, 3.569340852851009*^9, {3.5693411655067577`*^9, 3.5693411655067577`*^9}, 3.5693414976001415`*^9, {3.5693416978420925`*^9, 3.569341705314506*^9}, 3.569342614421703*^9, 3.5693435671777763`*^9, 3.569343662727944*^9, 3.5693437636289215`*^9, 3.5693440709750605`*^9, 3.5693442662562037`*^9, { 3.5702975520309644`*^9, 3.570297552764166*^9}, {3.5705591717487917`*^9, 3.5705591791432047`*^9}}], Cell[BoxData[ RowBox[{ RowBox[{"t", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"t1", "[", RowBox[{"[", RowBox[{"num", "[", RowBox[{"[", "i", "]"}], "]"}], "]"}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}]}], "]"}]}], ";"}]], "Input", CellChangeTimes->{{3.567869377256353*^9, 3.567869394073182*^9}, { 3.5678694248832364`*^9, 3.5678694526200852`*^9}, {3.5678694891241493`*^9, 3.5678694955045605`*^9}, {3.567869596046737*^9, 3.567869602645549*^9}, 3.56786971175214*^9, {3.5678697908910794`*^9, 3.567869798800293*^9}, { 3.5679434548425727`*^9, 3.5679434621121855`*^9}, 3.568011875875622*^9, 3.56811435956207*^9, {3.5682782821071444`*^9, 3.5682782839479475`*^9}, { 3.5688205455482616`*^9, 3.5688206262784038`*^9}, 3.5688208026055136`*^9, 3.5688732159559383`*^9, 3.568910867631465*^9, {3.5689830694736805`*^9, 3.568983072687286*^9}}], Cell[BoxData[ RowBox[{ RowBox[{"Plot1", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"Graphics3D", "[", RowBox[{"{", RowBox[{ RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", "\"\\""}], ",", RowBox[{"Lighter", "[", "Blue", "]"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", "\"\\""}], ",", RowBox[{"Lighter", "[", "Red", "]"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", "\"\\""}], ",", RowBox[{"Lighter", "[", "Green", "]"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", "\"\\""}], ",", RowBox[{"Lighter", "[", "Orange", "]"}], ",", RowBox[{"Lighter", "[", "Brown", "]"}]}], "]"}]}], "]"}]}], "]"}]}], "]"}], ",", RowBox[{"Sphere", "[", RowBox[{ RowBox[{"{", RowBox[{ RowBox[{"t", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], ",", RowBox[{"t", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], ",", RowBox[{"t", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}]}], "}"}], ",", RowBox[{"u1", "[", RowBox[{"[", "i", "]"}], "]"}]}], "]"}]}], "}"}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}]}], "]"}]}], ";"}]], "Input", CellChangeTimes->{{3.5679440895764875`*^9, 3.5679441000441055`*^9}, { 3.5679441319773617`*^9, 3.5679441523041973`*^9}, {3.567944240210352*^9, 3.5679442813476243`*^9}, {3.567944323966899*^9, 3.567944345931738*^9}, { 3.567944397567828*^9, 3.567944456941533*^9}, {3.567944491557994*^9, 3.5679445468444905`*^9}, {3.5679446505690727`*^9, 3.567944683875131*^9}, { 3.567944736244423*^9, 3.5679448177233667`*^9}, {3.567945549707852*^9, 3.5679455499730525`*^9}, {3.5679456039959474`*^9, 3.567945606195551*^9}, { 3.567945704460124*^9, 3.5679457164877453`*^9}, {3.5679457857362666`*^9, 3.5679458050023003`*^9}, {3.567946353670864*^9, 3.5679464127169676`*^9}, { 3.5679466013368993`*^9, 3.5679466311173515`*^9}, {3.5679467590999765`*^9, 3.567946915739851*^9}, {3.5679469466123056`*^9, 3.567946946815106*^9}, { 3.5679471385082426`*^9, 3.5679471497870626`*^9}, {3.5679483907224417`*^9, 3.5679484036080647`*^9}, {3.567948441937332*^9, 3.5679484421869326`*^9}, { 3.567948496740228*^9, 3.56794849772303*^9}, {3.567948847912445*^9, 3.5679488949933276`*^9}, {3.568011728877214*^9, 3.5680117308213253`*^9}, { 3.568011766325356*^9, 3.568011773436763*^9}, {3.5681173314452896`*^9, 3.5681173370612993`*^9}, {3.568117919800323*^9, 3.5681179678952074`*^9}, { 3.56811809459863*^9, 3.568118105409449*^9}, {3.5681181818963833`*^9, 3.5681182389144835`*^9}, {3.568118274888147*^9, 3.5681182883977704`*^9}, { 3.568118518513775*^9, 3.56811852739019*^9}, {3.5681188250543127`*^9, 3.568118862634779*^9}, {3.568118972396572*^9, 3.5681189862493963`*^9}, { 3.568119020694257*^9, 3.568119047136303*^9}, {3.5681190903015785`*^9, 3.568119136930061*^9}, {3.5681191671005135`*^9, 3.568119202808976*^9}, { 3.5681194788046613`*^9, 3.568119487603077*^9}, {3.5681195353235607`*^9, 3.5681195410331707`*^9}, 3.56811959201406*^9, {3.5681196426985493`*^9, 3.568119659702579*^9}, {3.568119726813897*^9, 3.56811974027672*^9}, { 3.5682659184078283`*^9, 3.5682659267694435`*^9}, {3.568265972477524*^9, 3.568266002725977*^9}, 3.568277802649102*^9, {3.568820898608082*^9, 3.568820922429324*^9}, 3.5688217528499823`*^9, 3.568821789307246*^9, { 3.569406212748887*^9, 3.569406252544557*^9}, {3.569492717066082*^9, 3.5694927471737347`*^9}, {3.5694931324008117`*^9, 3.5694931369404197`*^9}}], Cell[BoxData[ RowBox[{ RowBox[{"Plot2", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"Graphics3D", "[", RowBox[{"Text", "[", RowBox[{"i", ",", RowBox[{"{", RowBox[{ RowBox[{ RowBox[{"t", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "-", "0.6"}], ",", RowBox[{"t", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], ",", RowBox[{"t", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}]}], "}"}], " ", ",", RowBox[{"{", RowBox[{"1", ",", "0"}], "}"}]}], "]"}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}]}], "]"}]}], ";"}]], "Input", CellChangeTimes->{{3.5679440895764875`*^9, 3.5679441000441055`*^9}, { 3.5679441319773617`*^9, 3.5679441523041973`*^9}, {3.567944240210352*^9, 3.5679442813476243`*^9}, {3.567944323966899*^9, 3.567944345931738*^9}, { 3.567944397567828*^9, 3.567944456941533*^9}, {3.567944491557994*^9, 3.5679445468444905`*^9}, {3.5679446505690727`*^9, 3.567944683875131*^9}, { 3.567944736244423*^9, 3.5679448177233667`*^9}, {3.567945549707852*^9, 3.5679455499730525`*^9}, {3.5679456039959474`*^9, 3.567945606195551*^9}, { 3.567945704460124*^9, 3.5679457164877453`*^9}, {3.5679457857362666`*^9, 3.5679458050023003`*^9}, {3.567946353670864*^9, 3.5679464127169676`*^9}, { 3.5679466013368993`*^9, 3.5679466311173515`*^9}, {3.5679467590999765`*^9, 3.567946915739851*^9}, {3.5679469466123056`*^9, 3.567946946815106*^9}, { 3.5679471385082426`*^9, 3.5679471497870626`*^9}, {3.5679483907224417`*^9, 3.5679484036080647`*^9}, {3.567948441937332*^9, 3.5679484421869326`*^9}, { 3.567948496740228*^9, 3.56794849772303*^9}, {3.567948847912445*^9, 3.5679488949933276`*^9}, {3.568011728877214*^9, 3.5680117308213253`*^9}, { 3.568011766325356*^9, 3.568011773436763*^9}, {3.5681173314452896`*^9, 3.5681173370612993`*^9}, {3.568117919800323*^9, 3.5681179678952074`*^9}, { 3.56811809459863*^9, 3.568118105409449*^9}, {3.5681181818963833`*^9, 3.5681182389144835`*^9}, {3.568118274888147*^9, 3.5681182883977704`*^9}, { 3.568118518513775*^9, 3.56811852739019*^9}, {3.5681188250543127`*^9, 3.568118862634779*^9}, {3.568118972396572*^9, 3.5681189862493963`*^9}, { 3.568119020694257*^9, 3.568119047136303*^9}, {3.5681190903015785`*^9, 3.568119136930061*^9}, {3.5681191671005135`*^9, 3.568119202808976*^9}, { 3.5681194788046613`*^9, 3.568119487603077*^9}, {3.5681195353235607`*^9, 3.5681195410331707`*^9}, 3.56811959201406*^9, {3.5681196426985493`*^9, 3.568119659702579*^9}, {3.568119726813897*^9, 3.56811974027672*^9}, { 3.5681199008322024`*^9, 3.568119920691037*^9}, {3.5681199536070952`*^9, 3.568119958521104*^9}, {3.568120000641178*^9, 3.568120067206495*^9}, { 3.5681211528280015`*^9, 3.5681211643408213`*^9}, 3.5681213201694956`*^9, { 3.568121503313817*^9, 3.568121508961027*^9}, {3.568266015439999*^9, 3.5682660461096525`*^9}, 3.568277806081108*^9, {3.568381589141924*^9, 3.568381589391525*^9}, 3.5688217602599955`*^9, {3.568821800305266*^9, 3.568821801397268*^9}, 3.5693901242572327`*^9, {3.570559203182847*^9, 3.5705592101248593`*^9}}], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{"\[IndentingNewLine]", RowBox[{"ChemicalData", "\[NoBreak]", "[", RowBox[{"\"\\"", ",", "\"\\""}], "]"}]}]], "Input", CellChangeTimes->{{3.570856658569998*^9, 3.5708566598024*^9}, 3.5709425310382767`*^9, 3.5710435245708933`*^9, 3.5710448379216003`*^9, 3.571044955764207*^9}], Cell[BoxData[ GraphicsBox[{{ {GrayLevel[0], AbsoluteThickness[0.55], InsetBox[ StyleBox["\<\"C\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {286.6, -25.}], LineBox[{{303.9208810206263, -15.000645987399642`}, {329.905, 0.}}], {GrayLevel[0], InsetBox[ StyleBox["\<\"C\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {373.21, 25.}], LineBox[{{329.905, 0.}, {355.8891189793737, 15.000645987399652`}}]}}, {GrayLevel[0], AbsoluteThickness[0.55], InsetBox[ StyleBox["\<\"C\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {286.6, -25.}], LineBox[{{269.27961894742526`, -14.999779992739736`}, {243.3, 0.}}], {GrayLevel[0], InsetBox[ StyleBox["\<\"C\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {200., 25.}], LineBox[{{243.3, 0.}, {217.3203810525748, 14.999779992739736`}}]}}, {GrayLevel[0], AbsoluteThickness[0.55], InsetBox[ StyleBox["\<\"C\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {286.6, -25.}], LineBox[{{273.74402848350627`, -40.32070482605489}, {266.675, -48.745}}], {GrayLevel[0], InsetBox[ StyleBox["\<\"H\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {246.74999999999997`, -72.49}], LineBox[{{266.675, -48.745}, { 259.6059715164937, -57.169295173945116`}}]}}, {GrayLevel[0], AbsoluteThickness[0.55], InsetBox[ StyleBox["\<\"C\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {286.6, -25.}], LineBox[{{299.4578643243525, -40.31911632622926}, { 306.53000000000003`, -48.745}}], {GrayLevel[0], InsetBox[ StyleBox["\<\"H\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {326.46000000000004`, -72.49}], LineBox[{{306.53000000000003`, -48.745}, { 313.60213567564756`, -57.17088367377073}}]}}, {GrayLevel[0], AbsoluteThickness[0.55], InsetBox[ StyleBox["\<\"C\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {373.21, 25.}], LineBox[{{383.2104993870414, 7.679780255153105}, { 388.71, -1.8449999999999989`}}], {GrayLevel[0], InsetBox[ StyleBox["\<\"H\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {404.21, -28.689999999999998`}], LineBox[{{388.71, -1.8449999999999989`}, { 394.20950061295855`, -11.369780255153103`}}]}}, {GrayLevel[0], AbsoluteThickness[0.55], InsetBox[ StyleBox["\<\"C\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {373.21, 25.}], LineBox[{{390.5302197448469, 35.00049938704141}, {400.055, 40.5}}], {GrayLevel[0], InsetBox[ StyleBox["\<\"H\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {426.90000000000003`, 56.00000000000001}], LineBox[{{400.055, 40.5}, {409.57978025515314`, 45.99950061295859}}]}}, {GrayLevel[0], AbsoluteThickness[0.55], InsetBox[ StyleBox["\<\"C\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {373.21, 25.}], LineBox[{{363.20950061295855`, 42.320219744846895`}, {357.71, 51.845}}], {GrayLevel[0], InsetBox[ StyleBox["\<\"H\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {342.21, 78.69}], LineBox[{{357.71, 51.845}, {352.2104993870414, 61.3697802551531}}]}}, {GrayLevel[0], AbsoluteThickness[0.55], InsetBox[ StyleBox["\<\"C\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {200., 25.}], LineBox[{{210.00049938704143`, 42.320219744846895`}, {215.5, 51.845}}], {GrayLevel[0], InsetBox[ StyleBox["\<\"H\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {231., 78.69}], LineBox[{{215.5, 51.845}, {220.99950061295857`, 61.3697802551531}}]}}, {GrayLevel[0], AbsoluteThickness[0.55], InsetBox[ StyleBox["\<\"C\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {200., 25.}], LineBox[{{182.6797802551531, 35.000499387041415`}, {173.155, 40.5}}], {GrayLevel[0], InsetBox[ StyleBox["\<\"H\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {146.31, 56.00000000000001}], LineBox[{{173.155, 40.5}, {163.6302197448469, 45.999500612958585`}}]}}, {GrayLevel[0], AbsoluteThickness[0.55], InsetBox[ StyleBox["\<\"C\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {200., 25.}], LineBox[{{189.99950061295857`, 7.679780255153105}, { 184.5, -1.8449999999999989`}}], {GrayLevel[0], InsetBox[ StyleBox["\<\"H\"\>", StripOnInput->False, ScriptSizeMultipliers->0.8, ScriptMinSize->8, FontSize->Scaled[0.10086562882658977`], FontWeight->Plain], {169., -28.689999999999998`}], LineBox[{{184.5, -1.8449999999999989`}, { 179.00049938704143`, -11.369780255153103`}}]}}}, {}, {}}, ImageSize->{{0., 104.26166969147972`}, {0., 66.13727267358244}}, PlotRange->{{123.81, 444.90000000000003`}, {-102.49, 101.19}}]], "Output", CellChangeTimes->{3.571044997572281*^9, 3.5802161040901346`*^9}] }, Open ]], Cell[BoxData[ RowBox[{ StyleBox[ RowBox[{"(*", " ", RowBox[{"Distance", " ", "Matrix", " ", "Bohr"}], " ", "*)"}], "Text"], "\[IndentingNewLine]", RowBox[{ RowBox[{"dc", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"Sqrt", "[", RowBox[{ RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"t", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "-", RowBox[{"t", "[", RowBox[{"[", RowBox[{"j", ",", "1"}], "]"}], "]"}]}], ")"}], "^", "2"}], "+", RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"t", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "-", RowBox[{"t", "[", RowBox[{"[", RowBox[{"j", ",", "2"}], "]"}], "]"}]}], ")"}], "^", "2"}], "+", RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"t", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}], "-", RowBox[{"t", "[", RowBox[{"[", RowBox[{"j", ",", "3"}], "]"}], "]"}]}], ")"}], "^", "2"}]}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}], ",", RowBox[{"{", RowBox[{"j", ",", "1", ",", "n"}], "}"}]}], "]"}]}], ";"}]}]], "Input", CellChangeTimes->{{3.5678630319943895`*^9, 3.5678630956269007`*^9}, { 3.5678632280087337`*^9, 3.567863228336334*^9}, {3.5678632621727934`*^9, 3.5678633509213495`*^9}, {3.5678644293824434`*^9, 3.567864451908883*^9}, { 3.567864923404111*^9, 3.56786494544695*^9}, {3.5678650143210707`*^9, 3.5678650845367947`*^9}, {3.567869231084096*^9, 3.5678692412397137`*^9}, 3.5678693168686466`*^9, {3.5678704450470285`*^9, 3.5678704621290584`*^9}, 3.5682783281584253`*^9, 3.5688732159715385`*^9, 3.568910867647065*^9, 3.5689997098549547`*^9, 3.5689998170427427`*^9, 3.5689998869620657`*^9, 3.5691460426137285`*^9, 3.569237204536323*^9, 3.5692374658523817`*^9, 3.56923802264856*^9, 3.5693403424181123`*^9, 3.5693404502143016`*^9, 3.569340738019207*^9, 3.569340852851009*^9, 3.5693411655067577`*^9, 3.5693414978029413`*^9, 3.5693426144373026`*^9, 3.5693435671777763`*^9, 3.569343662743544*^9, 3.569343763644521*^9, 3.569344071177861*^9, 3.569344266271804*^9, 3.570297558707776*^9, {3.5703416079688015`*^9, 3.570341617375618*^9}, {3.5705956885798426`*^9, 3.5705957106070814`*^9}, { 3.5705965150536942`*^9, 3.5705965239457097`*^9}}], Cell[BoxData[{ RowBox[{ RowBox[{"x", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"t", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}]}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"y", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"t", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}]}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"z", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"t", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}]}], "]"}]}], ";"}]}], "Input", CellChangeTimes->{{3.5678630319943895`*^9, 3.5678630956269007`*^9}, { 3.5678632280087337`*^9, 3.567863228336334*^9}, {3.5678632621727934`*^9, 3.5678633509213495`*^9}, {3.5678644293824434`*^9, 3.567864451908883*^9}, { 3.567864923404111*^9, 3.56786494544695*^9}, {3.5678650143210707`*^9, 3.5678650845367947`*^9}, {3.567869231084096*^9, 3.567869278118179*^9}, { 3.5682778102931156`*^9, 3.5682778156907253`*^9}}], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{ RowBox[{"(*", " ", RowBox[{"connected", " ", RowBox[{"pairs", ":", " ", RowBox[{ RowBox[{"distance", " ", "criteria"}], " ", "<", " ", RowBox[{"3.0", " ", "bohr"}]}]}]}], " ", "*)"}], "\[IndentingNewLine]", RowBox[{ RowBox[{ RowBox[{"Dij", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"If", "[", RowBox[{ RowBox[{"i", "\[GreaterEqual]", "j"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{"(", RowBox[{ RowBox[{ RowBox[{"dc", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}], "<", "3.0"}], "||", RowBox[{"(", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", "\"\\""}], " ", "&&", " ", RowBox[{"j", "\[Equal]", "10"}], " ", "&&", " ", RowBox[{"i", "\[Equal]", " ", "17"}]}], ")"}]}], ")"}], ",", RowBox[{"dc", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}], ",", "0"}], "]"}], ",", "\"\< \>\""}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}], ",", RowBox[{"{", RowBox[{"j", ",", "1", ",", "n"}], "}"}]}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{"MatrixForm", "[", "Dij", "]"}]}]}]], "Input", CellChangeTimes->{{3.567863535157673*^9, 3.5678635412104836`*^9}, { 3.5678638182825704`*^9, 3.567863827283786*^9}, {3.5679503910983553`*^9, 3.5679504266352177`*^9}, {3.5679504653700857`*^9, 3.5679505048069553`*^9}, 3.567950534915008*^9, {3.567951107623214*^9, 3.567951136046464*^9}, 3.567951302545556*^9, {3.5679562986474605`*^9, 3.567956305355472*^9}, { 3.5679563590975666`*^9, 3.567956370688387*^9}, {3.567956414930065*^9, 3.567956430467692*^9}, {3.567956484740187*^9, 3.567956500667815*^9}, { 3.5679565456270943`*^9, 3.5679565868267665`*^9}, {3.5679569267045636`*^9, 3.5679569448941956`*^9}, {3.567956976562251*^9, 3.567957000711094*^9}, { 3.5679570348595533`*^9, 3.5679570632672033`*^9}, {3.5679573263928657`*^9, 3.5679573286548696`*^9}, {3.5679573611029263`*^9, 3.5679573637393312`*^9}, {3.5679592820903006`*^9, 3.567959317127962*^9}, { 3.567959397655304*^9, 3.5679594004945087`*^9}, {3.5679594704762316`*^9, 3.5679594724574347`*^9}, {3.567959655898157*^9, 3.567959673073787*^9}, 3.5681143121223865`*^9, 3.568121866388855*^9, 3.568220668221574*^9, { 3.568220718968463*^9, 3.568220723742071*^9}, {3.568220862051914*^9, 3.5682208641111183`*^9}, {3.568220906761593*^9, 3.5682209083527956`*^9}, { 3.5682209451844606`*^9, 3.5682209651680956`*^9}, {3.568221147782016*^9, 3.5682211695908546`*^9}, {3.568221237279373*^9, 3.568221253612602*^9}, { 3.568221305420293*^9, 3.568221306247094*^9}, {3.5682215161142635`*^9, 3.568221546206716*^9}, 3.56822158247678*^9, {3.568277819185131*^9, 3.5682778284359474`*^9}, 3.56882183684053*^9, {3.5688219650415554`*^9, 3.568821965915157*^9}, {3.5688769979329815`*^9, 3.5688771619984694`*^9}, { 3.568877204212144*^9, 3.5688772091729527`*^9}, {3.568877282493081*^9, 3.5688772843338842`*^9}, {3.568877374112042*^9, 3.568877378074449*^9}, { 3.56887744125456*^9, 3.5688774664954042`*^9}, {3.56887758366721*^9, 3.568877604867647*^9}, {3.568877667220957*^9, 3.5688776710429635`*^9}, { 3.5688778111156096`*^9, 3.56887782262843*^9}, {3.569341165522358*^9, 3.569341165522358*^9}, 3.5693418217375107`*^9, {3.5693429625675144`*^9, 3.5693429673099227`*^9}, {3.569390288837522*^9, 3.5693903143123665`*^9}, { 3.569390381798085*^9, 3.5693904158685455`*^9}, {3.5693905284539433`*^9, 3.569390564349606*^9}, {3.569390610868888*^9, 3.569390611056088*^9}, { 3.569390743671921*^9, 3.569390761487152*^9}, {3.569390843761697*^9, 3.569390861608128*^9}, {3.5693909829451413`*^9, 3.5693909887171516`*^9}, 3.5703416480920715`*^9, {3.5703416810237293`*^9, 3.5703416997437625`*^9}, 3.570341888192094*^9, {3.5705964879252462`*^9, 3.570596509843285*^9}, { 3.5705965495921545`*^9, 3.5705966388087115`*^9}, 3.570968886604662*^9, { 3.5709689930904493`*^9, 3.5709689944320517`*^9}, {3.5709690501397495`*^9, 3.570969050904151*^9}, {3.5709692134876366`*^9, 3.5709692140804377`*^9}, { 3.5709722325921392`*^9, 3.5709722334033403`*^9}, {3.5709723694355793`*^9, 3.570972545481889*^9}, {3.570972790558319*^9, 3.5709728063299465`*^9}, { 3.570972844066413*^9, 3.570972866764453*^9}, {3.5709729633598228`*^9, 3.57097298434186*^9}, {3.5709731454589424`*^9, 3.5709731466289444`*^9}, 3.570973453029083*^9, {3.5709736099653587`*^9, 3.570973638404208*^9}}], Cell[BoxData[ TagBox[ RowBox[{"(", "\[NoBreak]", GridBox[{ {"0.`", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", \ "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>"}, {"2.878090821114704`", "0.`", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", \ "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>"}, {"2.8780572609761808`", "0", "0.`", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", \ "\<\" \"\>", "\<\" \"\>", "\<\" \"\>"}, {"2.103267833842665`", "0", "0", "0.`", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", \ "\<\" \"\>", "\<\" \"\>"}, {"2.103122379607069`", "0", "0", "0", "0.`", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", \ "\<\" \"\>"}, {"0", "2.103292648752908`", "0", "0", "0", "0.`", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>"}, {"0", "2.1031787862012266`", "0", "0", "0", "0", "0.`", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>"}, {"0", "2.1034895820014827`", "0", "0", "0", "0", "0", "0.`", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>"}, {"0", "0", "2.1031686836643027`", "0", "0", "0", "0", "0", "0.`", "\<\" \"\>", "\<\" \"\>"}, {"0", "0", "2.1032707443399636`", "0", "0", "0", "0", "0", "0", "0.`", "\<\" \"\>"}, {"0", "0", "2.1032873185053806`", "0", "0", "0", "0", "0", "0", "0", "0.`"} }, GridBoxAlignment->{ "Columns" -> {{Center}}, "ColumnsIndexed" -> {}, "Rows" -> {{Baseline}}, "RowsIndexed" -> {}}, GridBoxSpacings->{"Columns" -> { Offset[0.27999999999999997`], { Offset[0.7]}, Offset[0.27999999999999997`]}, "ColumnsIndexed" -> {}, "Rows" -> { Offset[0.2], { Offset[0.4]}, Offset[0.2]}, "RowsIndexed" -> {}}], "\[NoBreak]", ")"}], Function[BoxForm`e$, MatrixForm[BoxForm`e$]]]], "Output", CellChangeTimes->{3.571044997603481*^9, 3.580216104105735*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[{ RowBox[{ RowBox[{ RowBox[{"nc", "=", "0"}], ";"}], " ", RowBox[{"(*", " ", RowBox[{ RowBox[{"parse", " ", "into", " ", "prim"}], ",", " ", "sec", ",", " ", "tert", ",", " ", RowBox[{ "and", " ", "quart", " ", "C", " ", "cores", " ", "with", " ", "different", " ", "radii"}]}], " ", "*)"}]}], "\[IndentingNewLine]", RowBox[{"For", "[", RowBox[{ RowBox[{"i", "=", "1"}], ",", RowBox[{"i", "<", RowBox[{"bc", "+", "1"}]}], ",", RowBox[{"i", "++"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", "\"\\""}], ",", RowBox[{"nc", "=", RowBox[{"nc", "+", "1"}]}], ",", "nc"}], "]"}]}], "]"}], "\n", RowBox[{ RowBox[{"cnt", "=", RowBox[{"Table", "[", RowBox[{"0", ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "nc"}], "}"}]}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"pri", "=", "cnt"}], ";", " ", RowBox[{"sec", "=", "cnt"}], ";", RowBox[{"ter", "=", "cnt"}], ";", " ", RowBox[{"qua", "=", "cnt"}], ";"}], "\[IndentingNewLine]", "nc"}], "Input", CellChangeTimes->{{3.5688800293771057`*^9, 3.5688801774057655`*^9}, { 3.5688802290574565`*^9, 3.568880330208034*^9}, {3.5688803807053227`*^9, 3.5688804136525807`*^9}, 3.568880491434317*^9, 3.5688805648948464`*^9, { 3.5688806280437574`*^9, 3.568880655234605*^9}, {3.568880712424306*^9, 3.568880716324312*^9}, {3.5688808087544746`*^9, 3.568880827786508*^9}, 3.5688808733385878`*^9, {3.568881358936241*^9, 3.5688813959239063`*^9}, { 3.568881446561595*^9, 3.5688815849182377`*^9}, {3.5688816223739033`*^9, 3.568881642607139*^9}, 3.568881728953291*^9, {3.568881797624612*^9, 3.568881809870633*^9}, 3.568881863612727*^9, {3.568883098916497*^9, 3.5688831014749017`*^9}, {3.56888372124679*^9, 3.568883843239004*^9}, 3.568888211750622*^9, {3.5688882521546926`*^9, 3.5688885232519693`*^9}, { 3.5688885890840845`*^9, 3.5688885895052853`*^9}, {3.568888675773437*^9, 3.5688886914514647`*^9}, {3.568888736285943*^9, 3.5688887717760057`*^9}, { 3.5688888256429005`*^9, 3.5688888541441507`*^9}, {3.568892442649892*^9, 3.5688924499507046`*^9}, {3.568892758441247*^9, 3.5688927597360487`*^9}, { 3.5688928234309607`*^9, 3.5688928379389863`*^9}, {3.5708938149488974`*^9, 3.5708938463361526`*^9}, {3.570893920483083*^9, 3.5708939282050962`*^9}, { 3.570894700000852*^9, 3.5708947833985987`*^9}}], Cell[BoxData["3"], "Output", CellChangeTimes->{3.5710449976190805`*^9, 3.580216104121335*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[{ RowBox[{ RowBox[{"For", "[", RowBox[{ RowBox[{"j", "=", "1"}], ",", RowBox[{"j", "<", RowBox[{"nc", "+", "1"}]}], ",", RowBox[{"j", "++"}], ",", "\[IndentingNewLine]", RowBox[{"For", "[", RowBox[{ RowBox[{"i", "=", RowBox[{"bc", "+", "1"}]}], ",", RowBox[{"i", "<", RowBox[{"n", "+", "1"}]}], ",", RowBox[{"i", "++"}], ",", RowBox[{"If", "[", " ", RowBox[{ RowBox[{ RowBox[{"Dij", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}], "\[NotEqual]", "0"}], " ", ",", RowBox[{ RowBox[{"cnt", "[", RowBox[{"[", "j", "]"}], "]"}], "=", RowBox[{ RowBox[{"cnt", "[", RowBox[{"[", "j", "]"}], "]"}], "+", "1"}]}], ",", "0"}], "]"}]}], "]"}]}], "]"}], ";"}], "\[IndentingNewLine]", "cnt"}], "Input", CellChangeTimes->{{3.5688800293771057`*^9, 3.5688801774057655`*^9}, { 3.5688802290574565`*^9, 3.568880330208034*^9}, {3.5688803807053227`*^9, 3.5688804136525807`*^9}, 3.568880491434317*^9, 3.5688805648948464`*^9, { 3.5688806280437574`*^9, 3.568880655234605*^9}, {3.568880712424306*^9, 3.568880716324312*^9}, {3.5688808087544746`*^9, 3.568880827786508*^9}, 3.5688808733385878`*^9, {3.568881358936241*^9, 3.5688813959239063`*^9}, { 3.568881446561595*^9, 3.5688815849182377`*^9}, {3.5688816223739033`*^9, 3.568881642607139*^9}, 3.568881728953291*^9, {3.568881797624612*^9, 3.568881809870633*^9}, 3.568881863612727*^9, {3.568883098916497*^9, 3.5688831014749017`*^9}, {3.56888372124679*^9, 3.568883843239004*^9}, 3.568888211750622*^9, {3.5688882521546926`*^9, 3.5688885232519693`*^9}, { 3.5688885890840845`*^9, 3.5688885895052853`*^9}, {3.568888675773437*^9, 3.5688886914514647`*^9}, {3.568888736285943*^9, 3.5688887717760057`*^9}, { 3.5688888256429005`*^9, 3.5688888541441507`*^9}, {3.568892442649892*^9, 3.5688924499507046`*^9}, {3.568892758441247*^9, 3.5688927597360487`*^9}, { 3.5688928234309607`*^9, 3.5688928379389863`*^9}, {3.5708938149488974`*^9, 3.5708938463361526`*^9}, {3.570893920483083*^9, 3.5708939282050962`*^9}, { 3.570894700000852*^9, 3.570894821930666*^9}, 3.5709437180911617`*^9}], Cell[BoxData[ RowBox[{"{", RowBox[{"2", ",", "3", ",", "3"}], "}"}]], "Output", CellChangeTimes->{3.5710449976346807`*^9, 3.5802161041369348`*^9}] }, Open ]], Cell[BoxData[{ RowBox[{ RowBox[{"n1", "=", "0"}], ";", " ", RowBox[{"n2", "=", "0"}], ";", " ", RowBox[{"n3", "=", "0"}], ";", " ", RowBox[{"n4", "=", "0"}], ";"}], "\n", RowBox[{ RowBox[{"For", "[", RowBox[{ RowBox[{"i", "=", "1"}], ",", RowBox[{"i", "<", RowBox[{"nc", "+", "1"}]}], ",", RowBox[{"i", "++"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{"(", RowBox[{ RowBox[{ RowBox[{"cnt", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", "3"}], " ", "||", " ", RowBox[{ RowBox[{"cnt", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", "4"}]}], ")"}], ",", RowBox[{ RowBox[{"n1", "=", RowBox[{"n1", "+", "1"}]}], ";", RowBox[{ RowBox[{"pri", "[", RowBox[{"[", "n1", "]"}], "]"}], "=", "i"}]}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"cnt", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", "2"}], ",", RowBox[{ RowBox[{"n2", "=", RowBox[{"n2", "+", "1"}]}], ";", RowBox[{ RowBox[{"sec", "[", RowBox[{"[", "n2", "]"}], "]"}], "=", "i"}]}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"cnt", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", "1"}], ",", RowBox[{ RowBox[{"n3", "=", RowBox[{"n3", "+", "1"}]}], ";", RowBox[{ RowBox[{"ter", "[", RowBox[{"[", "n3", "]"}], "]"}], "=", "i"}]}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"cnt", "[", RowBox[{"[", "i", "]"}], "]"}], "=", "0"}], ",", RowBox[{ RowBox[{"n4", "=", RowBox[{"n4", "+", "1"}]}], ";", RowBox[{ RowBox[{"qua", "[", RowBox[{"[", "n4", "]"}], "]"}], "=", "i"}]}]}], "]"}]}], "]"}]}], "]"}]}], "]"}]}], "]"}], ";"}], "\[IndentingNewLine]", RowBox[{"For", " ", "[", RowBox[{ RowBox[{"i", "=", "1"}], ",", " ", RowBox[{"i", "<", RowBox[{"nc", "+", "1"}]}], ",", RowBox[{"i", "++"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"pri", "[", RowBox[{"[", "i", "]"}], "]"}], "\[NotEqual]", "0"}], ",", RowBox[{ RowBox[{"u2", "[", RowBox[{"[", RowBox[{"pri", "[", RowBox[{"[", "i", "]"}], "]"}], "]"}], "]"}], "=", "0.254"}]}], "]"}]}], "]"}], "\[IndentingNewLine]", RowBox[{"For", " ", "[", RowBox[{ RowBox[{"i", "=", "1"}], ",", " ", RowBox[{"i", "<", RowBox[{"nc", "+", "1"}]}], ",", RowBox[{"i", "++"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"sec", "[", RowBox[{"[", "i", "]"}], "]"}], "\[NotEqual]", "0"}], ",", RowBox[{ RowBox[{"u2", "[", RowBox[{"[", RowBox[{"sec", "[", RowBox[{"[", "i", "]"}], "]"}], "]"}], "]"}], "=", "0.2557"}]}], "]"}]}], "]"}], "\[IndentingNewLine]", RowBox[{"For", " ", "[", RowBox[{ RowBox[{"i", "=", "1"}], ",", " ", RowBox[{"i", "<", RowBox[{"nc", "+", "1"}]}], ",", RowBox[{"i", "++"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"ter", "[", RowBox[{"[", "i", "]"}], "]"}], "\[NotEqual]", "0"}], ",", RowBox[{ RowBox[{"u2", "[", RowBox[{"[", RowBox[{"ter", "[", RowBox[{"[", "i", "]"}], "]"}], "]"}], "]"}], "=", "0.2567"}]}], "]"}]}], "]"}], "\[IndentingNewLine]", RowBox[{"For", " ", "[", RowBox[{ RowBox[{"i", "=", "1"}], ",", " ", RowBox[{"i", "<", RowBox[{"nc", "+", "1"}]}], ",", RowBox[{"i", "++"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"qua", "[", RowBox[{"[", "i", "]"}], "]"}], "\[NotEqual]", "0"}], ",", RowBox[{ RowBox[{"u2", "[", RowBox[{"[", RowBox[{"qua", "[", RowBox[{"[", "i", "]"}], "]"}], "]"}], "]"}], "=", "0.2577"}]}], "]"}]}], "]"}]}], "Input", CellChangeTimes->{{3.5688800293771057`*^9, 3.5688801774057655`*^9}, { 3.5688802290574565`*^9, 3.568880330208034*^9}, {3.5688803807053227`*^9, 3.5688804136525807`*^9}, 3.568880491434317*^9, 3.5688805648948464`*^9, { 3.5688806280437574`*^9, 3.568880655234605*^9}, {3.568880712424306*^9, 3.568880716324312*^9}, {3.5688808087544746`*^9, 3.568880827786508*^9}, 3.5688808733385878`*^9, {3.568881358936241*^9, 3.5688813959239063`*^9}, { 3.568881446561595*^9, 3.5688815849182377`*^9}, {3.5688816223739033`*^9, 3.568881642607139*^9}, 3.568881728953291*^9, {3.568881797624612*^9, 3.568881809870633*^9}, 3.568881863612727*^9, {3.568883098916497*^9, 3.5688831014749017`*^9}, {3.56888372124679*^9, 3.568883843239004*^9}, 3.568888211750622*^9, {3.5688882521546926`*^9, 3.5688885232519693`*^9}, { 3.5688885890840845`*^9, 3.5688885895052853`*^9}, {3.568888675773437*^9, 3.5688886914514647`*^9}, {3.568888736285943*^9, 3.5688887717760057`*^9}, { 3.5688888256429005`*^9, 3.5688888541441507`*^9}, {3.568892442649892*^9, 3.5688924499507046`*^9}, {3.568892758441247*^9, 3.5688927597360487`*^9}, { 3.5688928234309607`*^9, 3.5688928379389863`*^9}, {3.5708938149488974`*^9, 3.5708938463361526`*^9}, {3.570893920483083*^9, 3.5708939282050962`*^9}, { 3.570894700000852*^9, 3.5708948169698577`*^9}, {3.570894956839703*^9, 3.5708949736409326`*^9}, {3.5708961320833673`*^9, 3.570896139696181*^9}, 3.570896314088887*^9, {3.5708963602181683`*^9, 3.5708963666609793`*^9}, { 3.570896482038782*^9, 3.570896483645585*^9}, {3.5708965159376416`*^9, 3.570896521194851*^9}, {3.5709435995777535`*^9, 3.5709436285158043`*^9}, { 3.5709436695594764`*^9, 3.5709437026783347`*^9}, {3.57094471360691*^9, 3.5709447144805117`*^9}, {3.5710437875405555`*^9, 3.5710438014245796`*^9}, 3.5710438399722476`*^9, {3.5710439678924723`*^9, 3.5710439893581095`*^9}, { 3.5710441470743866`*^9, 3.5710441826580496`*^9}, 3.571044214450905*^9}], Cell[CellGroupData[{ Cell[BoxData[{ RowBox[{"For", "[", RowBox[{ RowBox[{"i", "=", "1"}], " ", ",", RowBox[{"i", "<", RowBox[{"n", "+", "1"}]}], ",", RowBox[{"i", "++"}], ",", "\[IndentingNewLine]", RowBox[{"For", "[", RowBox[{ RowBox[{"j", "=", "1"}], ",", " ", RowBox[{"j", "<", RowBox[{"bc", "+", "1"}]}], ",", RowBox[{"j", "++"}], ",", "\[IndentingNewLine]", RowBox[{"If", "[", RowBox[{ RowBox[{"(", RowBox[{ RowBox[{ RowBox[{"Dij", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}], "\[NotEqual]", "0"}], " ", "&&", " ", RowBox[{ RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}], "\[Equal]", " ", "\"\\""}]}], ")"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "j", "]"}], "]"}], "\[Equal]", "\"\\""}], ",", RowBox[{ RowBox[{"u2", "[", RowBox[{"[", "i", "]"}], "]"}], "=", "0.5693"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "j", "]"}], "]"}], "\[Equal]", "\"\\""}], ",", RowBox[{ RowBox[{"u2", "[", RowBox[{"[", "i", "]"}], "]"}], "=", "0.5"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "j", "]"}], "]"}], "\[Equal]", "\"\\""}], ",", RowBox[{ RowBox[{"u2", "[", RowBox[{"[", "i", "]"}], "]"}], "=", "0.5541"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "j", "]"}], "]"}], "\[Equal]", "\"\\""}], ",", RowBox[{ RowBox[{"u2", "[", RowBox[{"[", "i", "]"}], "]"}], "=", "0.5241"}]}], "]"}]}], "]"}]}], "]"}]}], "]"}]}], "]"}]}], "]"}]}], "]"}], "\[IndentingNewLine]", "u2"}], "Input", CellChangeTimes->{{3.5688800293771057`*^9, 3.5688801774057655`*^9}, { 3.5688802290574565`*^9, 3.568880330208034*^9}, {3.5688803807053227`*^9, 3.5688804136525807`*^9}, 3.568880491434317*^9, 3.5688805648948464`*^9, { 3.5688806280437574`*^9, 3.568880655234605*^9}, {3.568880712424306*^9, 3.568880716324312*^9}, {3.5688808087544746`*^9, 3.568880827786508*^9}, 3.5688808733385878`*^9, {3.568881358936241*^9, 3.5688813959239063`*^9}, { 3.568881446561595*^9, 3.5688815849182377`*^9}, {3.5688816223739033`*^9, 3.568881642607139*^9}, 3.568881728953291*^9, {3.568881797624612*^9, 3.568881809870633*^9}, 3.568881863612727*^9, {3.568883098916497*^9, 3.5688831014749017`*^9}, {3.56888372124679*^9, 3.568883843239004*^9}, 3.568888211750622*^9, {3.5688882521546926`*^9, 3.5688885232519693`*^9}, { 3.5688885890840845`*^9, 3.5688885895052853`*^9}, {3.568888675773437*^9, 3.5688886914514647`*^9}, {3.568888736285943*^9, 3.5688887717760057`*^9}, { 3.5688888256429005`*^9, 3.5688888541441507`*^9}, {3.568892442649892*^9, 3.5688924499507046`*^9}, {3.568892758441247*^9, 3.5688927597360487`*^9}, { 3.5688928234309607`*^9, 3.5688928379389863`*^9}, {3.5708938149488974`*^9, 3.5708938463361526`*^9}, {3.570893920483083*^9, 3.5708939282050962`*^9}, { 3.570894700000852*^9, 3.57089481264865*^9}, {3.570973331551669*^9, 3.570973355887712*^9}, {3.5709734060886*^9, 3.5709734077266035`*^9}, 3.5709737061863275`*^9}], Cell[BoxData[ RowBox[{"{", RowBox[{ "0.2557`", ",", "0.254`", ",", "0.254`", ",", "0.5693`", ",", "0.5693`", ",", "0.5693`", ",", "0.5693`", ",", "0.5693`", ",", "0.5693`", ",", "0.5693`", ",", "0.5693`"}], "}"}]], "Output", CellChangeTimes->{3.571044997650281*^9, 3.5802161041525345`*^9}] }, Open ]], Cell[BoxData[ RowBox[{ RowBox[{"(*", " ", RowBox[{ "subtract", " ", "core", " ", "radii", " ", "from", " ", "pair", " ", "distances"}], " ", "*)"}], "\[IndentingNewLine]", RowBox[{ RowBox[{ RowBox[{"Fij", "=", RowBox[{"Dij", "-", "u2"}]}], ";"}], "\[IndentingNewLine]", RowBox[{"(*", RowBox[{ RowBox[{"MatrixForm", "[", "Fij", "]"}], ";"}], "*)"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"Gij", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"If", "[", RowBox[{ RowBox[{"i", "\[GreaterEqual]", "j"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"Fij", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}], ">", "0"}], ",", RowBox[{"Fij", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}], ",", "0"}], "]"}], ",", "\"\< \>\""}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}], ",", RowBox[{"{", RowBox[{"j", ",", "1", ",", "n"}], "}"}]}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{"(*", RowBox[{ RowBox[{"MatrixForm", "[", "Gij", "]"}], ";"}], "*)"}]}]}]], "Input", CellChangeTimes->{{3.567958596890297*^9, 3.567958603270708*^9}, { 3.5679587604565845`*^9, 3.5679587707682023`*^9}, {3.5679588272871017`*^9, 3.567958828254304*^9}, {3.567959580066424*^9, 3.5679595814704266`*^9}, { 3.567959624994503*^9, 3.5679596300177116`*^9}, {3.5679597079086485`*^9, 3.567959902877791*^9}, {3.5679599961659546`*^9, 3.5679600446196404`*^9}, { 3.5679609611992497`*^9, 3.567960974006872*^9}, 3.567961975154231*^9, { 3.5679622637079377`*^9, 3.5679622945179915`*^9}, 3.5681142413606625`*^9, 3.568121878697276*^9, {3.5681219332193723`*^9, 3.56812197189184*^9}, { 3.5682778370003624`*^9, 3.5682778397927675`*^9}, {3.569341165522358*^9, 3.569341165537958*^9}, {3.5693418217531104`*^9, 3.5693418217531104`*^9}, { 3.57059671735485*^9, 3.570596744467697*^9}}], Cell[BoxData[{ RowBox[{ RowBox[{"Hij", "=", RowBox[{"Transpose", "[", "Gij", "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"(*", RowBox[{ RowBox[{"MatrixForm", "[", "Hij", "]"}], ";"}], "*)"}]}]}], "Input", CellChangeTimes->{{3.5679601758938704`*^9, 3.5679601965327067`*^9}, { 3.567960427147912*^9, 3.567960432217921*^9}, {3.5679605764089737`*^9, 3.5679605968294096`*^9}, {3.5679607389456596`*^9, 3.5679607643581038`*^9}, 3.5681142501278777`*^9, 3.5681218877140923`*^9, 3.569341165537958*^9, 3.5693418217531104`*^9}], Cell[BoxData[{ RowBox[{ RowBox[{ RowBox[{"Kij", "=", RowBox[{"Hij", "-", "u2"}]}], ";"}], "\[IndentingNewLine]", RowBox[{"(*", RowBox[{ RowBox[{"MatrixForm", "[", "Kij", "]"}], ";"}], "*)"}]}], "\[IndentingNewLine]", RowBox[{ RowBox[{"Lij", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"If", "[", RowBox[{ RowBox[{"i", "\[LessEqual]", "j"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"Kij", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}], ">", "0"}], ",", RowBox[{"Kij", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}], ",", "0"}], "]"}], ",", "\"\< \>\""}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}], ",", RowBox[{"{", RowBox[{"j", ",", "1", ",", "n"}], "}"}]}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"(*", RowBox[{ RowBox[{"MatrixForm", "[", "Lij", "]"}], ";"}], "*)"}]}]}], "Input", CellChangeTimes->{{3.5679602339571724`*^9, 3.567960257419614*^9}, { 3.567960343406965*^9, 3.567960353500182*^9}, {3.5679604155258913`*^9, 3.567960421422702*^9}, {3.567960854323462*^9, 3.567960874197897*^9}, { 3.5679611596939983`*^9, 3.567961170270817*^9}, {3.5679614000124207`*^9, 3.567961407016833*^9}, {3.5679615066074076`*^9, 3.567961509649413*^9}, 3.5679616124379935`*^9, 3.5679616766477065`*^9, {3.5679617424486217`*^9, 3.5679617456310277`*^9}, 3.567961801276325*^9, {3.5679618582788253`*^9, 3.5679618970760937`*^9}, {3.5679620279135237`*^9, 3.567962030113127*^9}, 3.567962107894864*^9, {3.567962149468937*^9, 3.5679621572533503`*^9}, 3.5679623389156694`*^9, {3.567962645815009*^9, 3.567962648888214*^9}, { 3.567962691647889*^9, 3.567962693020692*^9}, {3.568048161486014*^9, 3.568048162827616*^9}, 3.5680482096900983`*^9, 3.5681142588638926`*^9, 3.568121899632513*^9, 3.5681219958534822`*^9, {3.568277844675576*^9, 3.5682778463603787`*^9}, {3.569341165537958*^9, 3.569341165537958*^9}, { 3.5693418217531104`*^9, 3.5693418217531104`*^9}}], Cell[BoxData[ RowBox[{ RowBox[{"(*", " ", RowBox[{"determine", " ", "bond", " ", "cloud", " ", "radii"}], " ", "*)"}], "\[IndentingNewLine]", RowBox[{ RowBox[{ RowBox[{"Lij", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"If", "[", RowBox[{ RowBox[{"i", "\[LessEqual]", "j"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"Lij", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}], ">", "0"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "j", "]"}], "]"}], "\[NotEqual]", "\"\\""}], ",", RowBox[{"0.5", "*", RowBox[{"Lij", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}]}], ",", RowBox[{"Lij", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}]}], "]"}], ",", "0"}], "]"}], ",", "\"\< \>\""}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}], ",", RowBox[{"{", RowBox[{"j", ",", "1", ",", "n"}], "}"}]}], "]"}]}], ";"}], " ", "\[IndentingNewLine]", RowBox[{ RowBox[{"Qij", "=", "Lij"}], ";"}], "\[IndentingNewLine]", RowBox[{"(*", RowBox[{ RowBox[{"MatrixForm", "[", "Lij", "]"}], ";"}], "*)"}]}]}]], "Input", CellChangeTimes->{{3.5679627617388124`*^9, 3.567962837461345*^9}, { 3.567963118121438*^9, 3.567963118698639*^9}, {3.5679631520670977`*^9, 3.5679631541731014`*^9}, {3.5679631898191643`*^9, 3.5679632154656096`*^9}, {3.5679635823158536`*^9, 3.56796361468591*^9}, { 3.567963691516045*^9, 3.567963693590849*^9}, {3.567963737957327*^9, 3.567963807299449*^9}, {3.568048114904332*^9, 3.5680481161835346`*^9}, 3.5680482221389203`*^9, {3.5680485003498087`*^9, 3.5680485123618298`*^9}, 3.5681142659931054`*^9, 3.5681219084621286`*^9, {3.568277848107582*^9, 3.5682778496519847`*^9}, {3.5683793122399254`*^9, 3.568379313019926*^9}, { 3.568379456758579*^9, 3.56837947986222*^9}, 3.5683796000760307`*^9, { 3.5683796473285136`*^9, 3.5683796831617765`*^9}, {3.568381744939398*^9, 3.5683817743298492`*^9}, {3.56846523720809*^9, 3.568465240218895*^9}, 3.569341165537958*^9, 3.5693418217531104`*^9, {3.5705967846533675`*^9, 3.5705968020785985`*^9}}], Cell[BoxData[ RowBox[{ RowBox[{"(*", " ", RowBox[{"determine", " ", "kinetic", " ", "energy"}], " ", "*)"}], "\[IndentingNewLine]", RowBox[{ RowBox[{ RowBox[{"Nij", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"If", "[", RowBox[{ RowBox[{"i", "\[LessEqual]", "j"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"Lij", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}], ">", "0"}], ",", RowBox[{"2.25", "/", RowBox[{ RowBox[{"Lij", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}], "^", "2"}]}], ",", "0"}], "]"}], ",", "\"\< \>\""}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}], ",", RowBox[{"{", RowBox[{"j", ",", "1", ",", "n"}], "}"}]}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{"(*", RowBox[{"MatrixForm", "[", "Nij", "]"}], "*)"}]}]}]], "Input", CellChangeTimes->{{3.5679628944794455`*^9, 3.5679629710755796`*^9}, { 3.567963889963994*^9, 3.567963933800071*^9}, {3.5680478391738477`*^9, 3.5680478414358516`*^9}, 3.568048231171336*^9, {3.5680482823550262`*^9, 3.56804828449223*^9}, 3.5680483349271183`*^9, 3.568114273059918*^9, 3.5681219175101447`*^9, {3.568277851305588*^9, 3.568277857295998*^9}, { 3.5688722635742655`*^9, 3.568872266616271*^9}, 3.5688723032763357`*^9, 3.5688725225503206`*^9, 3.5692365125035076`*^9, {3.5692366381461277`*^9, 3.5692366389105296`*^9}, {3.5692366963654304`*^9, 3.5692366986898346`*^9}, 3.5693411655535583`*^9, 3.5693418217687106`*^9, {3.5705968460394754`*^9, 3.5705968602823005`*^9}}], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{"Tval", "=", RowBox[{"Sum", "[", RowBox[{ RowBox[{"If", "[", RowBox[{ RowBox[{"i", "\[LessEqual]", "j"}], ",", RowBox[{"Nij", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}], ",", "0"}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}], ",", RowBox[{"{", RowBox[{"j", ",", "1", ",", "n"}], "}"}]}], "]"}]}]], "Input", CellChangeTimes->{{3.567963992456174*^9, 3.567964003890994*^9}, { 3.5679640974287586`*^9, 3.5679642038209453`*^9}, {3.56796433180357*^9, 3.567964353487608*^9}, {3.567964403641696*^9, 3.567964453046983*^9}, { 3.5679646160984693`*^9, 3.5679646168316708`*^9}, {3.567964688747797*^9, 3.567964762255126*^9}, {3.568277859480002*^9, 3.568277863598409*^9}, { 3.568379511358675*^9, 3.5683795129030776`*^9}, 3.5688214977895346`*^9, { 3.56882774467134*^9, 3.56882781892747*^9}}], Cell[BoxData["14.203347616001999`"], "Output", CellChangeTimes->{3.571044997681481*^9, 3.5802161041681347`*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{"Tcor", "=", RowBox[{"Sum", "[", RowBox[{ RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", "i", "]"}], "]"}], "\[NotEqual]", "\"\\""}], ",", RowBox[{"2.25", "/", RowBox[{ RowBox[{"u2", "[", RowBox[{"[", "i", "]"}], "]"}], "^", "2"}]}], ",", "0"}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}]}], "]"}]}]], "Input", CellChangeTimes->{ 3.5688724058309155`*^9, {3.568872452646598*^9, 3.568872478480243*^9}, { 3.5688764461756124`*^9, 3.5688764647552447`*^9}, {3.5692363452556133`*^9, 3.5692363456924143`*^9}, 3.569236415892538*^9, 3.5692365043134933`*^9}], Cell[BoxData["104.16302282729822`"], "Output", CellChangeTimes->{3.5710449976970806`*^9, 3.580216104183735*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{"Ttot", "=", RowBox[{"Tval", "+", "Tcor", " ", RowBox[{"(*", " ", RowBox[{"plus", " ", "\[Pi]", " ", "and", " ", "lone", " ", RowBox[{"pairs", ":", " ", RowBox[{"+", " ", "8.7616"}]}]}], " ", "*)"}]}]}]], "Input", CellChangeTimes->{ 3.5688724058309155`*^9, {3.568872452646598*^9, 3.568872478480243*^9}, { 3.5688764461756124`*^9, 3.568876459248435*^9}, {3.568876733122516*^9, 3.5688767685033784`*^9}, {3.568895188410715*^9, 3.5688952349923964`*^9}}], Cell[BoxData["118.36637044330021`"], "Output", CellChangeTimes->{3.5710449976970806`*^9, 3.580216104199335*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{"TvalH", "=", RowBox[{"Sum", "[", RowBox[{ RowBox[{"If", "[", RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"i", "\[LessEqual]", "j"}], " ", "&&", " ", RowBox[{ RowBox[{"u", "[", RowBox[{"[", "j", "]"}], "]"}], "\[Equal]", " ", "\"\\""}]}], ")"}], ",", RowBox[{"Nij", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}], ",", "0"}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "n"}], "}"}], ",", RowBox[{"{", RowBox[{"j", ",", "1", ",", "n"}], "}"}]}], "]"}]}]], "Input", CellChangeTimes->{ 3.5688724058309155`*^9, {3.568872452646598*^9, 3.568872478480243*^9}, { 3.5688764461756124`*^9, 3.568876459248435*^9}, {3.568876733122516*^9, 3.5688767642445707`*^9}}], Cell[BoxData["10.994331334207029`"], "Output", CellChangeTimes->{3.571044997712681*^9, 3.580216104199335*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{"TvalC", "=", RowBox[{"Tval", "-", "TvalH"}]}]], "Input", CellChangeTimes->{{3.5688726088808727`*^9, 3.568872610581275*^9}, { 3.5688726952426243`*^9, 3.5688727146490583`*^9}}], Cell[BoxData["3.2090162817949697`"], "Output", CellChangeTimes->{3.571044997728281*^9, 3.580216104214935*^9}] }, Open ]], Cell[BoxData[ RowBox[{"\[IndentingNewLine]", RowBox[{ RowBox[{ RowBox[{"Mij", "=", RowBox[{"Prepend", "[", RowBox[{"Qij", ",", "u"}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"Oij", "=", RowBox[{"Transpose", "[", "Mij", "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"Pij", "=", RowBox[{"Prepend", "[", RowBox[{"Oij", ",", RowBox[{"Prepend", "[", RowBox[{"u", ",", "\"\< \>\""}], "]"}]}], "]"}]}], ";"}]}]}]], "Input", CellChangeTimes->{{3.568045828002715*^9, 3.56804588761042*^9}, 3.5680459828797874`*^9, {3.568046033938677*^9, 3.5680460518787084`*^9}, { 3.568046989190755*^9, 3.5680470284404235`*^9}, {3.568047061028881*^9, 3.568047085567724*^9}, {3.5680471562982483`*^9, 3.568047169199471*^9}, { 3.568047223393966*^9, 3.568047364059413*^9}, {3.568047417286707*^9, 3.5680474225127163`*^9}, {3.5680474583459787`*^9, 3.568047487861231*^9}, { 3.5680475345521126`*^9, 3.5680475468605347`*^9}, {3.5680479168775845`*^9, 3.5680479311516094`*^9}, {3.568048066918648*^9, 3.568048067667449*^9}, { 3.5680483816336*^9, 3.5680483930216208`*^9}, {3.568048424159275*^9, 3.568048450211321*^9}, {3.5680486326224413`*^9, 3.5680486370996494`*^9}, { 3.5680487358166227`*^9, 3.5680487967191296`*^9}, 3.568048834377596*^9, 3.568048984418659*^9, {3.5680490255559316`*^9, 3.5680490790796256`*^9}, { 3.5680491274553103`*^9, 3.5680491280949116`*^9}, {3.5680491782333994`*^9, 3.568049231944294*^9}, {3.568049361533722*^9, 3.5680493691933355`*^9}, { 3.568049422171028*^9, 3.568049427490638*^9}, {3.568049476427923*^9, 3.5680495489368505`*^9}, {3.568049620634577*^9, 3.5680496274361887`*^9}, { 3.5680496655314555`*^9, 3.568049693876705*^9}, 3.568049746573598*^9, { 3.568049846460573*^9, 3.568049932759925*^9}, {3.568050009059659*^9, 3.5680500167348723`*^9}, {3.5680501572755194`*^9, 3.568050179911159*^9}, 3.5681087021497335`*^9}], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{"MatrixForm", "[", "Pij", "]"}]], "Input", CellChangeTimes->{{3.568045828002715*^9, 3.56804588761042*^9}, 3.5680459828797874`*^9, {3.568046033938677*^9, 3.5680460518787084`*^9}, { 3.568046989190755*^9, 3.5680470284404235`*^9}, {3.568047061028881*^9, 3.568047085567724*^9}, {3.5680471562982483`*^9, 3.568047169199471*^9}, { 3.568047223393966*^9, 3.568047364059413*^9}, {3.568047417286707*^9, 3.5680474225127163`*^9}, {3.5680474583459787`*^9, 3.568047487861231*^9}, { 3.5680475345521126`*^9, 3.5680475468605347`*^9}, {3.5680479168775845`*^9, 3.5680479311516094`*^9}, {3.568048066918648*^9, 3.568048067667449*^9}, { 3.5680483816336*^9, 3.5680483930216208`*^9}, {3.568048424159275*^9, 3.568048450211321*^9}, {3.5680486326224413`*^9, 3.5680486370996494`*^9}, { 3.5680487358166227`*^9, 3.5680487967191296`*^9}, 3.568048834377596*^9, 3.568048984418659*^9, {3.5680490255559316`*^9, 3.5680490790796256`*^9}, { 3.5680491274553103`*^9, 3.5680491280949116`*^9}, {3.5680491782333994`*^9, 3.568049231944294*^9}, {3.568049361533722*^9, 3.5680493691933355`*^9}, { 3.568049422171028*^9, 3.568049427490638*^9}, {3.568049476427923*^9, 3.5680495489368505`*^9}, {3.568049620634577*^9, 3.5680496274361887`*^9}, { 3.5680496655314555`*^9, 3.568049693876705*^9}, 3.568049746573598*^9, { 3.568049846460573*^9, 3.568049932759925*^9}, {3.568050009059659*^9, 3.5680500167348723`*^9}, {3.5680501572755194`*^9, 3.568050179911159*^9}, { 3.5681087021497335`*^9, 3.5681087223049684`*^9}, 3.568114284401138*^9, 3.5681220092695055`*^9, 3.5693411655535583`*^9, 3.5693418217687106`*^9, { 3.570340755052903*^9, 3.5703407609185133`*^9}, 3.570342272888769*^9, { 3.5703428806034365`*^9, 3.5703428850182447`*^9}}], Cell[BoxData[ TagBox[ RowBox[{"(", "\[NoBreak]", GridBox[{ {"\<\" \"\>", "\<\"C\"\>", "\<\"C\"\>", "\<\"C\"\>", "\<\"H\"\>", "\<\"H\ \"\>", "\<\"H\"\>", "\<\"H\"\>", "\<\"H\"\>", "\<\"H\"\>", "\<\"H\"\>", \ "\<\"H\"\>"}, {"\<\"C\"\>", "0", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\ \<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>"}, {"\<\"C\"\>", "1.184195410557352`", "0", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\ \<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>"}, {"\<\"C\"\>", "1.1841786304880904`", "0", "0", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\ \<\" \"\>", "\<\" \"\>", "\<\" \"\>"}, {"\<\"H\"\>", "1.2782678338426647`", "0", "0", "0", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\ \<\" \"\>", "\<\" \"\>"}, {"\<\"H\"\>", "1.2781223796070686`", "0", "0", "0", "0", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\ \<\" \"\>"}, {"\<\"H\"\>", "0", "1.2799926487529079`", "0", "0", "0", "0", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>"}, {"\<\"H\"\>", "0", "1.2798787862012264`", "0", "0", "0", "0", "0", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>"}, {"\<\"H\"\>", "0", "1.2801895820014826`", "0", "0", "0", "0", "0", "0", "\<\" \"\>", "\<\" \"\>", "\<\" \"\>"}, {"\<\"H\"\>", "0", "0", "1.2798686836643025`", "0", "0", "0", "0", "0", "0", "\<\" \"\>", "\<\" \"\>"}, {"\<\"H\"\>", "0", "0", "1.2799707443399635`", "0", "0", "0", "0", "0", "0", "0", "\<\" \"\>"}, {"\<\"H\"\>", "0", "0", "1.2799873185053805`", "0", "0", "0", "0", "0", "0", "0", "0"} }, GridBoxAlignment->{ "Columns" -> {{Center}}, "ColumnsIndexed" -> {}, "Rows" -> {{Baseline}}, "RowsIndexed" -> {}}, GridBoxSpacings->{"Columns" -> { Offset[0.27999999999999997`], { Offset[0.7]}, Offset[0.27999999999999997`]}, "ColumnsIndexed" -> {}, "Rows" -> { Offset[0.2], { Offset[0.4]}, Offset[0.2]}, "RowsIndexed" -> {}}], "\[NoBreak]", ")"}], Function[BoxForm`e$, MatrixForm[BoxForm`e$]]]], "Output", CellChangeTimes->{3.571044997743881*^9, 3.580216104230535*^9}] }, Open ]], Cell[BoxData[ RowBox[{"(*", " ", RowBox[{"sigma", " ", "bond", " ", "cloud", " ", "radii"}], " ", "*)"}]], "Input", CellChangeTimes->{{3.568045828002715*^9, 3.56804588761042*^9}, 3.5680459828797874`*^9, {3.568046033938677*^9, 3.5680460518787084`*^9}, { 3.568046989190755*^9, 3.5680470284404235`*^9}, {3.568047061028881*^9, 3.568047085567724*^9}, {3.5680471562982483`*^9, 3.568047169199471*^9}, { 3.568047223393966*^9, 3.568047364059413*^9}, {3.568047417286707*^9, 3.5680474225127163`*^9}, {3.5680474583459787`*^9, 3.568047487861231*^9}, { 3.5680475345521126`*^9, 3.5680475468605347`*^9}, {3.5680479168775845`*^9, 3.5680479311516094`*^9}, {3.568048066918648*^9, 3.568048067667449*^9}, { 3.5680483816336*^9, 3.5680483930216208`*^9}, {3.568048424159275*^9, 3.568048450211321*^9}, {3.5680486326224413`*^9, 3.5680486370996494`*^9}, { 3.5680487358166227`*^9, 3.5680487967191296`*^9}, 3.568048834377596*^9, 3.568048984418659*^9, {3.5680490255559316`*^9, 3.5680490790796256`*^9}, { 3.5680491274553103`*^9, 3.5680491280949116`*^9}, {3.5680491782333994`*^9, 3.568049231944294*^9}, {3.568049361533722*^9, 3.5680493691933355`*^9}, { 3.568049422171028*^9, 3.568049427490638*^9}, {3.568049476427923*^9, 3.5680495489368505`*^9}, {3.568049620634577*^9, 3.5680496274361887`*^9}, { 3.5680496655314555`*^9, 3.568049693876705*^9}, 3.568049746573598*^9, { 3.568049846460573*^9, 3.568049932759925*^9}, {3.568050009059659*^9, 3.5680500167348723`*^9}, {3.5680501572755194`*^9, 3.568050179911159*^9}, { 3.5681087021497335`*^9, 3.5681087223049684`*^9}, {3.5681133837179556`*^9, 3.5681133888191648`*^9}}], Cell[BoxData[ RowBox[{"For", "[", RowBox[{ RowBox[{"i", "=", "2"}], ",", RowBox[{"i", "<", RowBox[{"n", "+", "2"}]}], ",", RowBox[{"i", "++"}], ",", "\[IndentingNewLine]", RowBox[{"For", "[", RowBox[{ RowBox[{"j", "=", "2"}], ",", RowBox[{"j", "\[LessEqual]", "i"}], ",", RowBox[{"j", "++"}], ",", "\[IndentingNewLine]", RowBox[{"If", "[", RowBox[{ RowBox[{"(", RowBox[{ RowBox[{ RowBox[{"Pij", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}], ">", "0"}], " ", "&&", " ", RowBox[{"(", " ", RowBox[{ RowBox[{ RowBox[{"u", "[", RowBox[{"[", RowBox[{"i", "-", "1"}], "]"}], "]"}], "\[Equal]", "\"\\""}], " ", "||", " ", RowBox[{ RowBox[{"u", "[", RowBox[{"[", RowBox[{"j", "-", "1"}], "]"}], "]"}], "\[Equal]", "\"\\""}]}], " ", ")"}]}], ")"}], " ", ",", RowBox[{"Print", "[", RowBox[{ RowBox[{"u", "[", RowBox[{"[", RowBox[{"i", "-", "1"}], "]"}], "]"}], ",", RowBox[{"i", "-", "1"}], ",", "\"\< \>\"", ",", RowBox[{"u", "[", RowBox[{"[", RowBox[{"j", "-", "1"}], "]"}], "]"}], ",", RowBox[{"j", "-", "1"}], ",", "\"\< \>\"", ",", RowBox[{"t", "[", RowBox[{"[", RowBox[{"i", "-", "1"}], "]"}], "]"}], ",", "\"\< \>\"", ",", RowBox[{"t", "[", RowBox[{"[", RowBox[{"j", "-", "1"}], "]"}], "]"}]}], "]"}]}], "]"}]}], "]"}]}], "]"}]], "Input", CellChangeTimes->{{3.568108824079547*^9, 3.568109012824279*^9}, { 3.568109558076436*^9, 3.568109588168889*^9}, {3.5681097523435774`*^9, 3.5681097637783976`*^9}, {3.5681100381828794`*^9, 3.5681101616726966`*^9}, {3.5681102015307665`*^9, 3.5681102288464146`*^9}, {3.568110263743676*^9, 3.568110267331682*^9}, { 3.5681103163469687`*^9, 3.5681103268925867`*^9}, {3.5681106443375444`*^9, 3.5681106916368275`*^9}, 3.568110873002746*^9, {3.5681109388660617`*^9, 3.5681110268970165`*^9}, {3.568111092526332*^9, 3.568111123461186*^9}, { 3.5681111884196997`*^9, 3.568111192756508*^9}, {3.5681112268113675`*^9, 3.568111366213212*^9}, {3.568111434946933*^9, 3.568111463354583*^9}, { 3.568111544396725*^9, 3.568111547625931*^9}, {3.5681116856081734`*^9, 3.5681117131422215`*^9}, {3.568111864696488*^9, 3.5681119835998964`*^9}, 3.5681120218355637`*^9, {3.56811206543764*^9, 3.568112066389242*^9}, { 3.568112332369709*^9, 3.5681123404505234`*^9}, {3.568112505935614*^9, 3.56811251481203*^9}, {3.5681125623609133`*^9, 3.568112569006525*^9}, { 3.568112648067464*^9, 3.568112734210815*^9}, {3.568112764443668*^9, 3.5681127697320776`*^9}, {3.5681128018681335`*^9, 3.568112843426607*^9}, { 3.568112884641879*^9, 3.5681128887602863`*^9}, {3.5681129663080225`*^9, 3.5681129699584293`*^9}, {3.568113133789917*^9, 3.568113227936082*^9}, { 3.5681132946885996`*^9, 3.5681133044698167`*^9}, {3.568113502200164*^9, 3.568113507348173*^9}, 3.56811354556824*^9, {3.5681222886191964`*^9, 3.5681222896019983`*^9}, {3.568207424138049*^9, 3.5682074415164795`*^9}, 3.568277923134914*^9, 3.568883508322016*^9, 3.568883588350157*^9, 3.5688836441982546`*^9, {3.5703421313965206`*^9, 3.5703421386505337`*^9}, { 3.570342288098796*^9, 3.5703424924279547`*^9}, 3.5709745658726373`*^9, 3.5709746291463485`*^9, {3.5709747534473667`*^9, 3.5709747617933817`*^9}, { 3.5709749537361183`*^9, 3.570975034747061*^9}, {3.5709751055243855`*^9, 3.5709751213584127`*^9}, {3.5709751694532976`*^9, 3.570975200060551*^9}}], Cell[BoxData[{ RowBox[{ RowBox[{"DeleteFile", "[", " ", "\"\\"", "]"}], ";"}], "\[IndentingNewLine]", RowBox[{"For", "[", RowBox[{ RowBox[{"i", "=", "2"}], ",", RowBox[{"i", "<", RowBox[{"n", "+", "2"}]}], ",", RowBox[{"i", "++"}], ",", "\[IndentingNewLine]", RowBox[{"For", "[", RowBox[{ RowBox[{"j", "=", "2"}], ",", RowBox[{"j", "\[LessEqual]", "i"}], ",", RowBox[{"j", "++"}], ",", "\[IndentingNewLine]", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"Pij", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}], ">", "0"}], ",", RowBox[{ RowBox[{"{", RowBox[{ RowBox[{"i", "-", "1"}], ",", RowBox[{"j", "-", "1"}], ",", RowBox[{"Extract", "[", RowBox[{"Pij", ",", RowBox[{"{", RowBox[{"i", ",", "j"}], "}"}]}], "]"}]}], "}"}], ">>>", " ", "\"\\""}]}], "]"}]}], "]"}]}], "]"}]}], "Input", CellChangeTimes->{{3.5681154444347754`*^9, 3.568115497147268*^9}, { 3.568127214924899*^9, 3.568127265796589*^9}, {3.568128215276656*^9, 3.568128238536297*^9}, {3.568130718566253*^9, 3.5681307485339055`*^9}, 3.5681308175952272`*^9, {3.5681308916497574`*^9, 3.5681309458598523`*^9}, { 3.5681309983383446`*^9, 3.5681310118947687`*^9}, {3.5681310723448744`*^9, 3.568131074357278*^9}, {3.5681315215476637`*^9, 3.568131584509374*^9}, { 3.56813162789305*^9, 3.5681316427754765`*^9}, {3.5681317113063965`*^9, 3.568131715268804*^9}, {3.5681323203938665`*^9, 3.5681323260098763`*^9}, { 3.568132387567585*^9, 3.568132440014877*^9}, {3.5681325121026034`*^9, 3.568132590945142*^9}, {3.56813274298981*^9, 3.5681327548302307`*^9}, { 3.568132877867647*^9, 3.568132888335265*^9}, {3.568133052345154*^9, 3.568133072344389*^9}, {3.5681331740533676`*^9, 3.5681331951446047`*^9}, { 3.568133267793932*^9, 3.5681332684803333`*^9}, {3.5681335079111547`*^9, 3.568133536833606*^9}, {3.5681336272201643`*^9, 3.5681336314945717`*^9}, { 3.568133737994359*^9, 3.568133744000369*^9}, {3.568133978515581*^9, 3.5681339917912045`*^9}, {3.5681340324916763`*^9, 3.5681340418204927`*^9}, {3.568134244262048*^9, 3.5681342454944506`*^9}, { 3.5681343354754086`*^9, 3.568134336099409*^9}, {3.5681345828762426`*^9, 3.568134583952645*^9}, {3.5681348406666956`*^9, 3.5681348474683075`*^9}, 3.568134889151581*^9, {3.5681352914606876`*^9, 3.568135296265496*^9}, { 3.568135518877887*^9, 3.568135519595488*^9}, 3.5681357593679094`*^9, { 3.5681787035360527`*^9, 3.568178728449296*^9}, 3.5682779128076954`*^9}], Cell[CellGroupData[{ Cell[BoxData[{ RowBox[{"a", "=", RowBox[{ "ReadList", "[", "\"\\"", "]"}]}], "\[IndentingNewLine]", RowBox[{"nb", "=", RowBox[{"Length", "[", "a", "]"}]}], "\[IndentingNewLine]", RowBox[{"cw", "=", RowBox[{"nb", "-", "bh"}]}]}], "Input", CellChangeTimes->{{3.5681343270045934`*^9, 3.568134331481801*^9}, 3.5681343823222904`*^9, {3.5681345934218616`*^9, 3.5681345986322703`*^9}, { 3.568134635479535*^9, 3.5681346521559644`*^9}, {3.5681351451792307`*^9, 3.568135145428831*^9}, {3.5681351781888885`*^9, 3.5681352349417877`*^9}, { 3.568135340163973*^9, 3.568135340335573*^9}, {3.568135523495495*^9, 3.5681355244314966`*^9}, {3.5681357674799232`*^9, 3.5681357771675406`*^9}, {3.568136284433632*^9, 3.5681362987700567`*^9}, { 3.568136395053426*^9, 3.5681363965510283`*^9}, {3.568381170343589*^9, 3.568381179844005*^9}, {3.5689533222924633`*^9, 3.568953376658559*^9}}], Cell[BoxData[ RowBox[{"{", RowBox[{ RowBox[{"{", RowBox[{"2", ",", "1", ",", "1.184195410557352`"}], "}"}], ",", RowBox[{"{", RowBox[{"3", ",", "1", ",", "1.1841786304880904`"}], "}"}], ",", RowBox[{"{", RowBox[{"4", ",", "1", ",", "1.2782678338426647`"}], "}"}], ",", RowBox[{"{", RowBox[{"5", ",", "1", ",", "1.2781223796070686`"}], "}"}], ",", RowBox[{"{", RowBox[{"6", ",", "2", ",", "1.2799926487529079`"}], "}"}], ",", RowBox[{"{", RowBox[{"7", ",", "2", ",", "1.2798787862012264`"}], "}"}], ",", RowBox[{"{", RowBox[{"8", ",", "2", ",", "1.2801895820014826`"}], "}"}], ",", RowBox[{"{", RowBox[{"9", ",", "3", ",", "1.2798686836643025`"}], "}"}], ",", RowBox[{"{", RowBox[{"10", ",", "3", ",", "1.2799707443399635`"}], "}"}], ",", RowBox[{"{", RowBox[{"11", ",", "3", ",", "1.2799873185053805`"}], "}"}]}], "}"}]], "Output", CellChangeTimes->{3.5710449977750807`*^9, 3.580216104261735*^9}], Cell[BoxData["10"], "Output", CellChangeTimes->{3.5710449977750807`*^9, 3.580216104261735*^9}], Cell[BoxData["2"], "Output", CellChangeTimes->{3.5710449977750807`*^9, 3.580216104261735*^9}] }, Open ]], Cell[BoxData[{ RowBox[{ RowBox[{"wxc", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{ RowBox[{ RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}], "+", RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}]}], ")"}], "/", RowBox[{"(", RowBox[{ RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}], "+", RowBox[{"2", "*", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}]}], "+", RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}]}], ")"}]}], "*", RowBox[{"(", RowBox[{ RowBox[{"x", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}], "-", RowBox[{"x", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}]}], ")"}]}], "+", RowBox[{"x", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}]}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "cw"}], "}"}]}], "]"}]}], ";"}], "\n", RowBox[{ RowBox[{ RowBox[{"wyc", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{ RowBox[{ RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}], "+", RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}]}], ")"}], "/", RowBox[{"(", RowBox[{ RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}], "+", RowBox[{"2", "*", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}]}], "+", RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}]}], ")"}]}], "*", RowBox[{"(", RowBox[{ RowBox[{"y", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}], "-", RowBox[{"y", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}]}], ")"}]}], "+", RowBox[{"y", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}]}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "cw"}], "}"}]}], "]"}]}], ";"}], " "}], "\n", RowBox[{ RowBox[{"wzc", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{ RowBox[{ RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}], "+", RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}]}], ")"}], "/", RowBox[{"(", RowBox[{ RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}], "+", RowBox[{"2", "*", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}]}], "+", RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}]}], ")"}]}], "*", RowBox[{"(", RowBox[{ RowBox[{"z", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}], "-", RowBox[{"z", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}]}], ")"}]}], "+", RowBox[{"z", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}]}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "cw"}], "}"}]}], "]"}]}], ";"}]}], "Input", CellChangeTimes->{{3.5681365021632137`*^9, 3.5681365171392403`*^9}, { 3.568136560351316*^9, 3.5681365863097615`*^9}, {3.5681369135895367`*^9, 3.5681369265999594`*^9}, {3.568137821916732*^9, 3.5681378378443604`*^9}, { 3.5682072492149415`*^9, 3.5682072529901485`*^9}, 3.568209802830227*^9, { 3.5682216503836985`*^9, 3.5682217583046885`*^9}, {3.5682217912831464`*^9, 3.568221843465238*^9}, {3.5682219760654707`*^9, 3.5682221133457117`*^9}, { 3.568222159615393*^9, 3.5682221693498106`*^9}, {3.5682222565227633`*^9, 3.5682222578487663`*^9}, 3.5682224736283445`*^9, 3.5682227227607822`*^9, 3.5682227558640404`*^9, {3.568222818810151*^9, 3.5682228486062036`*^9}, { 3.5682230057764797`*^9, 3.5682230079916835`*^9}, {3.568223041952943*^9, 3.5682230548229656`*^9}, 3.5682232619601297`*^9, 3.5682233000709963`*^9, { 3.568223536645412*^9, 3.5682235381118145`*^9}, {3.568223591151908*^9, 3.568223591526308*^9}, {3.5682236491528096`*^9, 3.568223657483224*^9}, { 3.568223713222122*^9, 3.5682237532361927`*^9}, {3.568223800379475*^9, 3.568223827648323*^9}, {3.5682238887380304`*^9, 3.5682238893152313`*^9}, { 3.5682240287170763`*^9, 3.5682240612431335`*^9}, 3.5682241088076167`*^9, { 3.568224198772975*^9, 3.5682242396450467`*^9}, {3.568224282170721*^9, 3.5682243185031853`*^9}, {3.568224437890195*^9, 3.568224439590598*^9}, { 3.568224572253231*^9, 3.5682245867144566`*^9}, {3.5682247081762695`*^9, 3.568224733557514*^9}, {3.56822480520844*^9, 3.5682248433505073`*^9}, { 3.568224884206979*^9, 3.5682248959069996`*^9}, {3.568224982830352*^9, 3.5682250047639904`*^9}, {3.56822503870965*^9, 3.5682250803305235`*^9}, { 3.5682251223413973`*^9, 3.568225141451431*^9}, {3.568225234177994*^9, 3.5682252929588966`*^9}, {3.5682253775890455`*^9, 3.568225482140429*^9}, { 3.56822551694409*^9, 3.5682255297205124`*^9}, {3.568225573197789*^9, 3.5682255809666023`*^9}, 3.568225660698343*^9, 3.5682257301964645`*^9, { 3.568225765078126*^9, 3.5682257828933573`*^9}, {3.568225927026843*^9, 3.568225927416844*^9}, {3.568267062420238*^9, 3.568267081358671*^9}, { 3.568267188328059*^9, 3.5682672830358257`*^9}, {3.5682676367040462`*^9, 3.568267747979042*^9}, 3.5682678404716043`*^9, 3.568267882030078*^9, { 3.5682679252577534`*^9, 3.568267996612279*^9}, {3.5682680488879704`*^9, 3.568268061133992*^9}, {3.568268100914062*^9, 3.5682681150944867`*^9}, { 3.5682681672609787`*^9, 3.5682681709113846`*^9}, {3.568268272904364*^9, 3.5682683182536435`*^9}, {3.5682685202739983`*^9, 3.568268599194537*^9}, { 3.5682686348873997`*^9, 3.568268637773405*^9}, {3.5682686944951043`*^9, 3.568268872273017*^9}, {3.5682689420207396`*^9, 3.568269016947671*^9}, { 3.5682695040741262`*^9, 3.568269601153097*^9}, {3.5682696652380095`*^9, 3.5682696728352227`*^9}, {3.5682697489633565`*^9, 3.5682698308635006`*^9}, {3.568271156491429*^9, 3.568271160063835*^9}, { 3.568271244927984*^9, 3.568271369010602*^9}, {3.5682716250070515`*^9, 3.5682717312276382`*^9}, {3.5682717843301315`*^9, 3.5682718576814604`*^9}, {3.568271940673606*^9, 3.5682720536490045`*^9}, { 3.5682722259669075`*^9, 3.5682723223126764`*^9}, {3.568272370813162*^9, 3.568272411466833*^9}, {3.5682725893539457`*^9, 3.568272622238803*^9}, { 3.5682726936713285`*^9, 3.5682726960113325`*^9}, {3.568272741079812*^9, 3.56827275143823*^9}, {3.5682729218373294`*^9, 3.568272991070251*^9}, { 3.5682734285574193`*^9, 3.5682734302890224`*^9}, {3.5682734898811274`*^9, 3.5682735111595645`*^9}, {3.5682736115925407`*^9, 3.5682736313577757`*^9}, {3.5682738601945777`*^9, 3.568273987272401*^9}, { 3.5682763944346285`*^9, 3.5682764313910933`*^9}, 3.5682765128232365`*^9, { 3.5682766527398825`*^9, 3.568276660976697*^9}, {3.5682774496048822`*^9, 3.568277461663703*^9}, {3.5683784032731285`*^9, 3.568378422991563*^9}, { 3.568378459308427*^9, 3.5683784812420654`*^9}, {3.568378513440522*^9, 3.568378867046343*^9}, {3.568378915468828*^9, 3.56837896203491*^9}, { 3.5683790764299107`*^9, 3.568379270041851*^9}, {3.568380233530743*^9, 3.568380234388745*^9}, 3.5683804214954734`*^9, 3.568380471867962*^9, 3.5683805399464817`*^9, {3.5683812396077104`*^9, 3.568381293537005*^9}, { 3.568381339541486*^9, 3.5683813935175805`*^9}, 3.5684646396646404`*^9, 3.5684646988823442`*^9, 3.568465086387025*^9, {3.5684655859935026`*^9, 3.568465605087936*^9}, 3.568821235038273*^9, 3.5688233741452303`*^9, 3.568823449742963*^9, 3.5688274593312387`*^9, {3.5688284679978104`*^9, 3.5688284689026117`*^9}, {3.5688285131598897`*^9, 3.5688285201487017`*^9}, 3.5688285866360188`*^9, {3.5688292397623663`*^9, 3.568829246688778*^9}, { 3.5688780328231993`*^9, 3.568878075458074*^9}, 3.5688953020257144`*^9, 3.5693395777359695`*^9, {3.569339615191635*^9, 3.569339617079238*^9}, { 3.5693396917877693`*^9, 3.56933969216217*^9}, 3.5693893483274703`*^9}], Cell[BoxData[ RowBox[{ RowBox[{"Plot7", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"Graphics3D", "[", RowBox[{"{", RowBox[{ RowBox[{"Lighter", "[", RowBox[{"Brown", ",", "0.6"}], "]"}], ",", RowBox[{"Opacity", "[", "0.6", "]"}], ",", RowBox[{"If", "[", RowBox[{ RowBox[{ RowBox[{"wxc", "[", RowBox[{"[", "i", "]"}], "]"}], "\[NotEqual]", "0"}], ",", RowBox[{"Sphere", "[", RowBox[{ RowBox[{"{", RowBox[{ RowBox[{"wxc", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"wyc", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"wzc", "[", RowBox[{"[", "i", "]"}], "]"}]}], "}"}], ",", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}]}], "]"}]}], "]"}]}], "}"}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "cw"}], "}"}]}], "]"}]}], ";"}]], "Input", CellChangeTimes->{{3.5681365021632137`*^9, 3.5681365171392403`*^9}, { 3.568136560351316*^9, 3.5681365863097615`*^9}, {3.5681369135895367`*^9, 3.5681369265999594`*^9}, {3.568137821916732*^9, 3.5681378378443604`*^9}, { 3.5682072492149415`*^9, 3.5682072529901485`*^9}, 3.568209802830227*^9, { 3.5682216503836985`*^9, 3.5682217583046885`*^9}, {3.5682217912831464`*^9, 3.568221843465238*^9}, {3.5682219760654707`*^9, 3.5682221133457117`*^9}, { 3.568222159615393*^9, 3.5682221693498106`*^9}, {3.5682222565227633`*^9, 3.5682222578487663`*^9}, 3.5682224736283445`*^9, 3.5682227227607822`*^9, 3.5682227558640404`*^9, {3.568222818810151*^9, 3.5682228486062036`*^9}, { 3.5682230057764797`*^9, 3.5682230079916835`*^9}, {3.568223041952943*^9, 3.5682230548229656`*^9}, 3.5682232619601297`*^9, 3.5682233000709963`*^9, { 3.568223536645412*^9, 3.5682235381118145`*^9}, {3.568223591151908*^9, 3.568223591526308*^9}, {3.5682236491528096`*^9, 3.568223657483224*^9}, { 3.568223713222122*^9, 3.5682237532361927`*^9}, {3.568223800379475*^9, 3.568223827648323*^9}, {3.5682238887380304`*^9, 3.5682238893152313`*^9}, { 3.5682240287170763`*^9, 3.5682240612431335`*^9}, 3.5682241088076167`*^9, { 3.568224198772975*^9, 3.5682242396450467`*^9}, {3.568224282170721*^9, 3.5682243185031853`*^9}, {3.568224437890195*^9, 3.568224439590598*^9}, { 3.568224572253231*^9, 3.5682245867144566`*^9}, {3.5682247081762695`*^9, 3.568224733557514*^9}, {3.56822480520844*^9, 3.5682248433505073`*^9}, { 3.568224884206979*^9, 3.5682248959069996`*^9}, {3.568224982830352*^9, 3.5682250047639904`*^9}, {3.56822503870965*^9, 3.5682250803305235`*^9}, { 3.5682251223413973`*^9, 3.568225141451431*^9}, {3.568225234177994*^9, 3.5682252929588966`*^9}, {3.5682253775890455`*^9, 3.568225482140429*^9}, { 3.56822551694409*^9, 3.5682255297205124`*^9}, {3.568225573197789*^9, 3.5682255809666023`*^9}, 3.568225660698343*^9, 3.5682257301964645`*^9, { 3.568225765078126*^9, 3.5682257828933573`*^9}, {3.568225927026843*^9, 3.568225927416844*^9}, {3.568267062420238*^9, 3.568267081358671*^9}, { 3.568267188328059*^9, 3.5682672830358257`*^9}, {3.5682676367040462`*^9, 3.568267747979042*^9}, 3.5682678404716043`*^9, 3.568267882030078*^9, { 3.5682679252577534`*^9, 3.568267996612279*^9}, {3.5682680488879704`*^9, 3.568268061133992*^9}, {3.568268100914062*^9, 3.5682681150944867`*^9}, { 3.5682681672609787`*^9, 3.5682681709113846`*^9}, {3.568268272904364*^9, 3.5682683182536435`*^9}, {3.5682685202739983`*^9, 3.568268599194537*^9}, { 3.5682686348873997`*^9, 3.568268637773405*^9}, {3.5682686944951043`*^9, 3.568268872273017*^9}, {3.5682689420207396`*^9, 3.568269016947671*^9}, { 3.5682695040741262`*^9, 3.568269601153097*^9}, {3.5682696652380095`*^9, 3.5682696728352227`*^9}, {3.5682697489633565`*^9, 3.5682698308635006`*^9}, {3.568271156491429*^9, 3.568271160063835*^9}, { 3.568271244927984*^9, 3.568271369010602*^9}, {3.5682716250070515`*^9, 3.5682717312276382`*^9}, {3.5682717843301315`*^9, 3.5682718576814604`*^9}, {3.568271940673606*^9, 3.5682720536490045`*^9}, { 3.5682722259669075`*^9, 3.5682723223126764`*^9}, {3.568272370813162*^9, 3.568272411466833*^9}, {3.5682725893539457`*^9, 3.568272622238803*^9}, { 3.5682726936713285`*^9, 3.5682726960113325`*^9}, {3.568272741079812*^9, 3.56827275143823*^9}, {3.5682729218373294`*^9, 3.568272991070251*^9}, { 3.5682734285574193`*^9, 3.5682734302890224`*^9}, {3.5682734898811274`*^9, 3.5682735111595645`*^9}, {3.5682736115925407`*^9, 3.5682736313577757`*^9}, {3.5682738601945777`*^9, 3.568273987272401*^9}, { 3.5682763944346285`*^9, 3.5682764313910933`*^9}, 3.5682765128232365`*^9, { 3.5682766527398825`*^9, 3.568276660976697*^9}, {3.5682774496048822`*^9, 3.568277461663703*^9}, {3.5683784032731285`*^9, 3.568378422991563*^9}, { 3.568378459308427*^9, 3.5683784812420654`*^9}, {3.568378513440522*^9, 3.568378867046343*^9}, {3.568378915468828*^9, 3.56837896203491*^9}, { 3.5683790764299107`*^9, 3.568379270041851*^9}, {3.568380233530743*^9, 3.568380234388745*^9}, 3.5683804214954734`*^9, 3.568380471867962*^9, 3.5683805399464817`*^9, {3.5683812396077104`*^9, 3.568381293537005*^9}, { 3.568381339541486*^9, 3.5683813935175805`*^9}, 3.5684646396646404`*^9, 3.5684646988823442`*^9, 3.568465086387025*^9, {3.5684655859935026`*^9, 3.568465605087936*^9}, 3.568821235038273*^9, 3.5688233741452303`*^9, 3.568823449742963*^9, 3.5688274593312387`*^9, {3.5688284679978104`*^9, 3.5688284689026117`*^9}, {3.5688285131598897`*^9, 3.5688285201487017`*^9}, 3.5688285866360188`*^9, {3.5688292397623663`*^9, 3.568829246688778*^9}, { 3.5688780328231993`*^9, 3.56887811871695*^9}, {3.568895331556566*^9, 3.5688953367201753`*^9}, 3.568895995276532*^9, {3.5693397032225895`*^9, 3.56933970331619*^9}, 3.569339737137049*^9, 3.569340055299608*^9, 3.569389360947892*^9, {3.570298060155057*^9, 3.570298071589877*^9}, { 3.5704539766451664`*^9, 3.5704539773627677`*^9}, {3.5709509139026003`*^9, 3.570950950500265*^9}, {3.570950995397144*^9, 3.5709510449896307`*^9}, { 3.570974064815357*^9, 3.5709741190878525`*^9}, {3.5709742487084804`*^9, 3.570974273528124*^9}}], Cell[BoxData[{ RowBox[{ RowBox[{"wxh", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{ RowBox[{ RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}], "+", RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}]}], ")"}], "/", RowBox[{"(", RowBox[{ RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}], "+", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}], "+", RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}]}], ")"}]}], "*", RowBox[{"(", RowBox[{ RowBox[{"x", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}], "-", RowBox[{"x", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}]}], ")"}]}], "+", RowBox[{"x", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}]}], ",", RowBox[{"{", RowBox[{"i", ",", RowBox[{"cw", "+", "1"}], ",", "nb"}], "}"}]}], "]"}]}], ";"}], "\n", RowBox[{ RowBox[{"wyh", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{ RowBox[{ RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}], "+", RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}]}], ")"}], "/", RowBox[{"(", RowBox[{ RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}], "+", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}], "+", RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}]}], ")"}]}], "*", RowBox[{"(", RowBox[{ RowBox[{"y", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}], "-", RowBox[{"y", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}]}], ")"}]}], "+", RowBox[{"y", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}]}], ",", RowBox[{"{", RowBox[{"i", ",", RowBox[{"cw", "+", "1"}], ",", "nb"}], "}"}]}], "]"}]}], ";"}], "\n", RowBox[{ RowBox[{"wzh", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{ RowBox[{ RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}], "+", RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}]}], ")"}], "/", RowBox[{"(", RowBox[{ RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}], "+", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}], "+", RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}]}], ")"}]}], "*", RowBox[{"(", RowBox[{ RowBox[{"z", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}], "-", RowBox[{"z", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}]}], ")"}]}], "+", RowBox[{"z", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}]}], ",", RowBox[{"{", RowBox[{"i", ",", RowBox[{"cw", "+", "1"}], ",", "nb"}], "}"}]}], "]"}]}], ";"}]}], "Input", CellChangeTimes->{{3.5681365021632137`*^9, 3.5681365171392403`*^9}, { 3.568136560351316*^9, 3.5681365863097615`*^9}, {3.5681369135895367`*^9, 3.5681369265999594`*^9}, {3.568137821916732*^9, 3.5681378378443604`*^9}, { 3.5682072492149415`*^9, 3.5682072529901485`*^9}, 3.568209802830227*^9, { 3.5682216503836985`*^9, 3.5682217583046885`*^9}, {3.5682217912831464`*^9, 3.568221843465238*^9}, {3.5682219760654707`*^9, 3.5682221133457117`*^9}, { 3.568222159615393*^9, 3.5682221693498106`*^9}, {3.5682222565227633`*^9, 3.5682222578487663`*^9}, 3.5682224736283445`*^9, 3.5682227227607822`*^9, 3.5682227558640404`*^9, {3.568222818810151*^9, 3.5682228486062036`*^9}, { 3.5682230057764797`*^9, 3.5682230079916835`*^9}, {3.568223041952943*^9, 3.5682230548229656`*^9}, 3.5682232619601297`*^9, 3.5682233000709963`*^9, { 3.568223536645412*^9, 3.5682235381118145`*^9}, {3.568223591151908*^9, 3.568223591526308*^9}, {3.5682236491528096`*^9, 3.568223657483224*^9}, { 3.568223713222122*^9, 3.5682237532361927`*^9}, {3.568223800379475*^9, 3.568223827648323*^9}, {3.5682238887380304`*^9, 3.5682238893152313`*^9}, { 3.5682240287170763`*^9, 3.5682240612431335`*^9}, 3.5682241088076167`*^9, { 3.568224198772975*^9, 3.5682242396450467`*^9}, {3.568224282170721*^9, 3.5682243185031853`*^9}, {3.568224437890195*^9, 3.568224439590598*^9}, { 3.568224572253231*^9, 3.5682245867144566`*^9}, {3.5682247081762695`*^9, 3.568224733557514*^9}, {3.56822480520844*^9, 3.5682248433505073`*^9}, { 3.568224884206979*^9, 3.5682248959069996`*^9}, {3.568224982830352*^9, 3.5682250047639904`*^9}, {3.56822503870965*^9, 3.5682250803305235`*^9}, { 3.5682251223413973`*^9, 3.568225141451431*^9}, {3.568225234177994*^9, 3.5682252929588966`*^9}, {3.5682253775890455`*^9, 3.568225482140429*^9}, { 3.56822551694409*^9, 3.5682255297205124`*^9}, {3.568225573197789*^9, 3.5682255809666023`*^9}, 3.568225660698343*^9, 3.5682257301964645`*^9, { 3.568225765078126*^9, 3.5682257828933573`*^9}, {3.568225927026843*^9, 3.568225927416844*^9}, {3.568267062420238*^9, 3.568267081358671*^9}, { 3.568267188328059*^9, 3.5682672830358257`*^9}, {3.5682676367040462`*^9, 3.568267747979042*^9}, 3.5682678404716043`*^9, 3.568267882030078*^9, { 3.5682679252577534`*^9, 3.568267996612279*^9}, {3.5682680488879704`*^9, 3.568268061133992*^9}, {3.568268100914062*^9, 3.5682681150944867`*^9}, { 3.5682681672609787`*^9, 3.5682681709113846`*^9}, {3.568268272904364*^9, 3.5682683182536435`*^9}, {3.5682685202739983`*^9, 3.568268599194537*^9}, { 3.5682686348873997`*^9, 3.568268637773405*^9}, {3.5682686944951043`*^9, 3.568268872273017*^9}, {3.5682689420207396`*^9, 3.568269016947671*^9}, { 3.5682695040741262`*^9, 3.568269601153097*^9}, {3.5682696652380095`*^9, 3.5682696728352227`*^9}, {3.5682697489633565`*^9, 3.5682698308635006`*^9}, {3.568271156491429*^9, 3.568271160063835*^9}, { 3.568271244927984*^9, 3.568271369010602*^9}, {3.5682716250070515`*^9, 3.5682717312276382`*^9}, {3.5682717843301315`*^9, 3.5682718576814604`*^9}, {3.568271940673606*^9, 3.5682720536490045`*^9}, { 3.5682722259669075`*^9, 3.5682723223126764`*^9}, {3.568272370813162*^9, 3.568272411466833*^9}, {3.5682725893539457`*^9, 3.568272622238803*^9}, { 3.5682726936713285`*^9, 3.5682726960113325`*^9}, {3.568272741079812*^9, 3.56827275143823*^9}, {3.5682729218373294`*^9, 3.568272991070251*^9}, { 3.5682734285574193`*^9, 3.5682734302890224`*^9}, {3.5682734898811274`*^9, 3.5682735111595645`*^9}, {3.5682736115925407`*^9, 3.5682736313577757`*^9}, {3.5682738601945777`*^9, 3.568273987272401*^9}, { 3.5682763944346285`*^9, 3.5682764313910933`*^9}, 3.5682765128232365`*^9, { 3.5682766527398825`*^9, 3.568276660976697*^9}, {3.5682774496048822`*^9, 3.568277461663703*^9}, {3.5683784032731285`*^9, 3.568378422991563*^9}, { 3.568378459308427*^9, 3.5683784812420654`*^9}, {3.568378513440522*^9, 3.568378867046343*^9}, {3.568378915468828*^9, 3.56837896203491*^9}, { 3.5683790764299107`*^9, 3.568379270041851*^9}, {3.568380233530743*^9, 3.568380234388745*^9}, 3.5683804214954734`*^9, 3.568380471867962*^9, 3.5683805399464817`*^9, {3.5683812396077104`*^9, 3.568381293537005*^9}, { 3.568381339541486*^9, 3.5683813935175805`*^9}, 3.5684646396646404`*^9, 3.5684646988823442`*^9, 3.568465086387025*^9, {3.5684655859935026`*^9, 3.568465605087936*^9}, 3.568821235038273*^9, 3.5688233741452303`*^9, 3.568823449742963*^9, 3.5688274593312387`*^9, {3.5688284679978104`*^9, 3.5688284689026117`*^9}, {3.5688285131598897`*^9, 3.5688285201487017`*^9}, 3.5688285866360188`*^9, {3.5688292397623663`*^9, 3.568829246688778*^9}, { 3.5688780328231993`*^9, 3.5688781280925665`*^9}, 3.568895312524533*^9, 3.5693395940691977`*^9, {3.5693396336776676`*^9, 3.5693396557829065`*^9}, { 3.569340069402033*^9, 3.569340092412073*^9}, {3.569389186383586*^9, 3.5693891947764006`*^9}, {3.569389263291721*^9, 3.569389289686967*^9}, 3.569389336315449*^9}], Cell[BoxData[ RowBox[{ RowBox[{"Plot8", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"Graphics3D", "[", RowBox[{"{", RowBox[{ RowBox[{"Opacity", "[", "0.5", "]"}], ",", RowBox[{"Sphere", "[", RowBox[{ RowBox[{"{", RowBox[{ RowBox[{"wxh", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"wyh", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"wzh", "[", RowBox[{"[", "i", "]"}], "]"}]}], "}"}], ",", RowBox[{"a", "[", RowBox[{"[", RowBox[{ RowBox[{"i", "+", "cw"}], ",", "3"}], "]"}], "]"}]}], "]"}]}], "}"}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "bh"}], "}"}]}], "]"}]}], ";"}]], "Input", CellChangeTimes->{{3.5681365021632137`*^9, 3.5681365171392403`*^9}, { 3.568136560351316*^9, 3.5681365863097615`*^9}, {3.5681369135895367`*^9, 3.5681369265999594`*^9}, {3.568137821916732*^9, 3.5681378378443604`*^9}, { 3.5682072492149415`*^9, 3.5682072529901485`*^9}, 3.568209802830227*^9, { 3.5682216503836985`*^9, 3.5682217583046885`*^9}, {3.5682217912831464`*^9, 3.568221843465238*^9}, {3.5682219760654707`*^9, 3.5682221133457117`*^9}, { 3.568222159615393*^9, 3.5682221693498106`*^9}, {3.5682222565227633`*^9, 3.5682222578487663`*^9}, 3.5682224736283445`*^9, 3.5682227227607822`*^9, 3.5682227558640404`*^9, {3.568222818810151*^9, 3.5682228486062036`*^9}, { 3.5682230057764797`*^9, 3.5682230079916835`*^9}, {3.568223041952943*^9, 3.5682230548229656`*^9}, 3.5682232619601297`*^9, 3.5682233000709963`*^9, { 3.568223536645412*^9, 3.5682235381118145`*^9}, {3.568223591151908*^9, 3.568223591526308*^9}, {3.5682236491528096`*^9, 3.568223657483224*^9}, { 3.568223713222122*^9, 3.5682237532361927`*^9}, {3.568223800379475*^9, 3.568223827648323*^9}, {3.5682238887380304`*^9, 3.5682238893152313`*^9}, { 3.5682240287170763`*^9, 3.5682240612431335`*^9}, 3.5682241088076167`*^9, { 3.568224198772975*^9, 3.5682242396450467`*^9}, {3.568224282170721*^9, 3.5682243185031853`*^9}, {3.568224437890195*^9, 3.568224439590598*^9}, { 3.568224572253231*^9, 3.5682245867144566`*^9}, {3.5682247081762695`*^9, 3.568224733557514*^9}, {3.56822480520844*^9, 3.5682248433505073`*^9}, { 3.568224884206979*^9, 3.5682248959069996`*^9}, {3.568224982830352*^9, 3.5682250047639904`*^9}, {3.56822503870965*^9, 3.5682250803305235`*^9}, { 3.5682251223413973`*^9, 3.568225141451431*^9}, {3.568225234177994*^9, 3.5682252929588966`*^9}, {3.5682253775890455`*^9, 3.568225482140429*^9}, { 3.56822551694409*^9, 3.5682255297205124`*^9}, {3.568225573197789*^9, 3.5682255809666023`*^9}, 3.568225660698343*^9, 3.5682257301964645`*^9, { 3.568225765078126*^9, 3.5682257828933573`*^9}, {3.568225927026843*^9, 3.568225927416844*^9}, {3.568267062420238*^9, 3.568267081358671*^9}, { 3.568267188328059*^9, 3.5682672830358257`*^9}, {3.5682676367040462`*^9, 3.568267747979042*^9}, 3.5682678404716043`*^9, 3.568267882030078*^9, { 3.5682679252577534`*^9, 3.568267996612279*^9}, {3.5682680488879704`*^9, 3.568268061133992*^9}, {3.568268100914062*^9, 3.5682681150944867`*^9}, { 3.5682681672609787`*^9, 3.5682681709113846`*^9}, {3.568268272904364*^9, 3.5682683182536435`*^9}, {3.5682685202739983`*^9, 3.568268599194537*^9}, { 3.5682686348873997`*^9, 3.568268637773405*^9}, {3.5682686944951043`*^9, 3.568268872273017*^9}, {3.5682689420207396`*^9, 3.568269016947671*^9}, { 3.5682695040741262`*^9, 3.568269601153097*^9}, {3.5682696652380095`*^9, 3.5682696728352227`*^9}, {3.5682697489633565`*^9, 3.5682698308635006`*^9}, {3.568271156491429*^9, 3.568271160063835*^9}, { 3.568271244927984*^9, 3.568271369010602*^9}, {3.5682716250070515`*^9, 3.5682717312276382`*^9}, {3.5682717843301315`*^9, 3.5682718576814604`*^9}, {3.568271940673606*^9, 3.5682720536490045`*^9}, { 3.5682722259669075`*^9, 3.5682723223126764`*^9}, {3.568272370813162*^9, 3.568272411466833*^9}, {3.5682725893539457`*^9, 3.568272622238803*^9}, { 3.5682726936713285`*^9, 3.5682726960113325`*^9}, {3.568272741079812*^9, 3.56827275143823*^9}, {3.5682729218373294`*^9, 3.568272991070251*^9}, { 3.5682734285574193`*^9, 3.5682734302890224`*^9}, {3.5682734898811274`*^9, 3.5682735111595645`*^9}, {3.5682736115925407`*^9, 3.5682736313577757`*^9}, {3.5682738601945777`*^9, 3.568273987272401*^9}, { 3.5682763944346285`*^9, 3.5682764313910933`*^9}, 3.5682765128232365`*^9, { 3.5682766527398825`*^9, 3.568276660976697*^9}, {3.5682774496048822`*^9, 3.568277461663703*^9}, {3.5683784032731285`*^9, 3.568378422991563*^9}, { 3.568378459308427*^9, 3.5683784812420654`*^9}, {3.568378513440522*^9, 3.568378867046343*^9}, {3.568378915468828*^9, 3.56837896203491*^9}, { 3.5683790764299107`*^9, 3.568379270041851*^9}, {3.568380233530743*^9, 3.568380234388745*^9}, 3.5683804214954734`*^9, 3.568380471867962*^9, 3.5683805399464817`*^9, {3.5683812396077104`*^9, 3.568381293537005*^9}, { 3.568381339541486*^9, 3.5683813935175805`*^9}, 3.5684646396646404`*^9, 3.5684646988823442`*^9, 3.568465086387025*^9, {3.5684655859935026`*^9, 3.568465605087936*^9}, 3.568821235038273*^9, 3.5688233741452303`*^9, 3.568823449742963*^9, 3.5688274593312387`*^9, {3.5688284679978104`*^9, 3.5688284689026117`*^9}, {3.5688285131598897`*^9, 3.5688285201487017`*^9}, 3.5688285866360188`*^9, {3.5688292397623663`*^9, 3.568829246688778*^9}, { 3.5688780328231993`*^9, 3.568878147967001*^9}, {3.56889532230575*^9, 3.5688953242557535`*^9}, 3.56889600529175*^9, 3.5688961595292206`*^9, { 3.5693396821781526`*^9, 3.5693396825213532`*^9}, 3.5693893658151007`*^9, { 3.5693895413934093`*^9, 3.5693895427506113`*^9}, {3.5697651043452682`*^9, 3.5697651089940763`*^9}, {3.5704647001766*^9, 3.570464712141821*^9}}], Cell[CellGroupData[{ Cell[BoxData[{ RowBox[{ RowBox[{"Plot9", "=", " ", RowBox[{"Table", "[", RowBox[{ RowBox[{"Graphics3D", "[", RowBox[{"{", RowBox[{"(*", RowBox[{ RowBox[{"Darker", "[", RowBox[{"Red", ",", "0.8"}], "]"}], ","}], "*)"}], RowBox[{"Tube", "[", RowBox[{ RowBox[{"{", RowBox[{ RowBox[{"{", RowBox[{ RowBox[{"x", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}], ",", RowBox[{"y", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}], ",", RowBox[{"z", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}]}], "}"}], ",", RowBox[{"{", RowBox[{ RowBox[{"x", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}], ",", RowBox[{"y", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}], ",", RowBox[{"z", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "]"}], "]"}]}], "}"}]}], "}"}], ",", "0.1"}], "]"}], "}"}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "nb"}], "}"}]}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{"Show", "[", RowBox[{ "Plot1", ",", "Plot2", ",", "Plot7", ",", "Plot8", ",", "Plot9", ",", RowBox[{"{", RowBox[{ RowBox[{"AspectRatio", "\[Rule]", "Automatic"}], ",", RowBox[{"Boxed", "->", "False"}], ",", " ", RowBox[{"SphericalRegion", "\[Rule]", "True"}]}], "}"}]}], "]"}], "\[IndentingNewLine]", RowBox[{"Show", "[", RowBox[{"Plot1", ",", "Plot2", ",", "Plot9", ",", RowBox[{"{", RowBox[{ RowBox[{"AspectRatio", "\[Rule]", "Automatic"}], ",", RowBox[{"Boxed", "\[Rule]", "True"}], ",", " ", RowBox[{"SphericalRegion", "\[Rule]", "True"}]}], "}"}]}], "]"}], "\[IndentingNewLine]"}], "Input", CellChangeTimes->{{3.5681365021632137`*^9, 3.5681365171392403`*^9}, { 3.568136560351316*^9, 3.5681365863097615`*^9}, {3.5681369135895367`*^9, 3.5681369265999594`*^9}, {3.568137821916732*^9, 3.5681378378443604`*^9}, { 3.5682072492149415`*^9, 3.5682072529901485`*^9}, 3.568209802830227*^9, { 3.5682216503836985`*^9, 3.5682217583046885`*^9}, {3.5682217912831464`*^9, 3.568221843465238*^9}, {3.5682219760654707`*^9, 3.5682221133457117`*^9}, { 3.568222159615393*^9, 3.5682221693498106`*^9}, {3.5682222565227633`*^9, 3.5682222578487663`*^9}, 3.5682224736283445`*^9, 3.5682227227607822`*^9, 3.5682227558640404`*^9, {3.568222818810151*^9, 3.5682228486062036`*^9}, { 3.5682230057764797`*^9, 3.5682230079916835`*^9}, {3.568223041952943*^9, 3.5682230548229656`*^9}, 3.5682232619601297`*^9, 3.5682233000709963`*^9, { 3.568223536645412*^9, 3.5682235381118145`*^9}, {3.568223591151908*^9, 3.568223591526308*^9}, {3.5682236491528096`*^9, 3.568223657483224*^9}, { 3.568223713222122*^9, 3.5682237532361927`*^9}, {3.568223800379475*^9, 3.568223827648323*^9}, {3.5682238887380304`*^9, 3.5682238893152313`*^9}, { 3.5682240287170763`*^9, 3.5682240612431335`*^9}, 3.5682241088076167`*^9, { 3.568224198772975*^9, 3.5682242396450467`*^9}, {3.568224282170721*^9, 3.5682243185031853`*^9}, {3.568224437890195*^9, 3.568224439590598*^9}, { 3.568224572253231*^9, 3.5682245867144566`*^9}, {3.5682247081762695`*^9, 3.568224733557514*^9}, {3.56822480520844*^9, 3.5682248433505073`*^9}, { 3.568224884206979*^9, 3.5682248959069996`*^9}, {3.568224982830352*^9, 3.5682250047639904`*^9}, {3.56822503870965*^9, 3.5682250803305235`*^9}, { 3.5682251223413973`*^9, 3.568225141451431*^9}, {3.568225234177994*^9, 3.5682252929588966`*^9}, {3.5682253775890455`*^9, 3.568225482140429*^9}, { 3.56822551694409*^9, 3.5682255297205124`*^9}, {3.568225573197789*^9, 3.5682255809666023`*^9}, 3.568225660698343*^9, 3.5682257301964645`*^9, { 3.568225765078126*^9, 3.5682257828933573`*^9}, {3.568225927026843*^9, 3.568225927416844*^9}, {3.568267062420238*^9, 3.568267081358671*^9}, { 3.568267188328059*^9, 3.5682672830358257`*^9}, {3.5682676367040462`*^9, 3.568267747979042*^9}, 3.5682678404716043`*^9, 3.568267882030078*^9, { 3.5682679252577534`*^9, 3.568267996612279*^9}, {3.5682680488879704`*^9, 3.568268061133992*^9}, {3.568268100914062*^9, 3.5682681150944867`*^9}, { 3.5682681672609787`*^9, 3.5682681709113846`*^9}, {3.568268272904364*^9, 3.5682683182536435`*^9}, {3.5682685202739983`*^9, 3.568268599194537*^9}, { 3.5682686348873997`*^9, 3.568268637773405*^9}, {3.5682686944951043`*^9, 3.568268872273017*^9}, {3.5682689420207396`*^9, 3.568269016947671*^9}, { 3.5682695040741262`*^9, 3.568269601153097*^9}, {3.5682696652380095`*^9, 3.5682696728352227`*^9}, {3.5682697489633565`*^9, 3.5682698308635006`*^9}, {3.568271156491429*^9, 3.568271160063835*^9}, { 3.568271244927984*^9, 3.568271369010602*^9}, {3.5682716250070515`*^9, 3.5682717312276382`*^9}, {3.5682717843301315`*^9, 3.5682718576814604`*^9}, {3.568271940673606*^9, 3.5682720536490045`*^9}, { 3.5682722259669075`*^9, 3.5682723223126764`*^9}, {3.568272370813162*^9, 3.568272411466833*^9}, {3.5682725893539457`*^9, 3.568272622238803*^9}, { 3.5682726936713285`*^9, 3.5682726960113325`*^9}, {3.568272741079812*^9, 3.56827275143823*^9}, {3.5682729218373294`*^9, 3.568272991070251*^9}, { 3.5682734285574193`*^9, 3.5682734302890224`*^9}, {3.5682734898811274`*^9, 3.5682735111595645`*^9}, {3.5682736115925407`*^9, 3.5682736313577757`*^9}, {3.5682738601945777`*^9, 3.568273987272401*^9}, { 3.5682763944346285`*^9, 3.5682764313910933`*^9}, 3.5682765128232365`*^9, { 3.5682766527398825`*^9, 3.568276660976697*^9}, {3.5682774496048822`*^9, 3.568277461663703*^9}, {3.5683784032731285`*^9, 3.568378422991563*^9}, { 3.568378459308427*^9, 3.5683784812420654`*^9}, {3.568378513440522*^9, 3.568378867046343*^9}, {3.568378915468828*^9, 3.56837896203491*^9}, { 3.5683790764299107`*^9, 3.568379270041851*^9}, {3.568380233530743*^9, 3.568380234388745*^9}, 3.5683804214954734`*^9, 3.568380471867962*^9, 3.5683805399464817`*^9, {3.5683812396077104`*^9, 3.568381293537005*^9}, { 3.568381339541486*^9, 3.568381420224828*^9}, {3.5684645223056345`*^9, 3.5684645572340956`*^9}, {3.5684651558539467`*^9, 3.5684651618911576`*^9}, {3.5688209923798466`*^9, 3.568820997683856*^9}, { 3.568821158754139*^9, 3.568821160750942*^9}, 3.56882222404881*^9, { 3.568822649274357*^9, 3.5688226508031597`*^9}, 3.568822723109287*^9, { 3.5693397221142225`*^9, 3.5693397223326235`*^9}, {3.5693899272912874`*^9, 3.5693899274472876`*^9}, {3.5693910617720795`*^9, 3.5693910848757205`*^9}, 3.5693911374166126`*^9, {3.569391214402748*^9, 3.5693912147147484`*^9}, 3.569391451944365*^9, {3.569391487793228*^9, 3.569391507620863*^9}, { 3.5693923162258854`*^9, 3.5693923173958874`*^9}, {3.569406068526634*^9, 3.569406086092265*^9}, 3.569690172138941*^9, 3.569780036185542*^9, { 3.570453906913044*^9, 3.5704539079894457`*^9}, {3.570454575670618*^9, 3.5704545899602437`*^9}, {3.570454765008151*^9, 3.570454772277764*^9}, 3.5708553779481487`*^9, {3.5709431726830034`*^9, 3.570943174555007*^9}, { 3.5709495710522423`*^9, 3.5709495907082767`*^9}, {3.570949647617176*^9, 3.570949673138821*^9}, {3.570950759321929*^9, 3.5709507772775607`*^9}, { 3.5709508127364225`*^9, 3.5709508405200715`*^9}, {3.570991123104905*^9, 3.570991124259307*^9}, {3.5709912161278687`*^9, 3.570991227937089*^9}, { 3.5709912804155817`*^9, 3.570991308776431*^9}, {3.5709914026885962`*^9, 3.5709914215490294`*^9}, {3.570991574429298*^9, 3.5709916038821497`*^9}, 3.570991652445035*^9, 3.570991830004547*^9, 3.570991865276209*^9, { 3.5709919181759014`*^9, 3.5709919260539155`*^9}, {3.570992027251293*^9, 3.570992050058533*^9}, 3.5709920901350036`*^9, 3.570992186979974*^9, 3.5710436291378775`*^9}], Cell[BoxData[ Graphics3DBox[{ {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{-0.20712152850399998`, -0.826505681168, -0.8576162403059999}, 0.255]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{-2.05386760036, -0.0924153492766, 1.22422119458}, 0.255]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{2.20916528304, 0.7124191430959999, -0.58106239911}, 0.255]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{-1.073848137856, -0.43764542379199994`, -2.7341311658399996`}, 0.1]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{0.24309057318799998`, -2.8751614172199997`, -0.704506860334}, 0.1]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{-1.185427009526, -0.48186123274, 3.09984983862}, 0.1]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{-3.8201189035199996`, -1.2160651371639999`, 1.021419579712}, 0.1]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{-2.5053987308, 1.95645222506, 1.072795560474}, 0.1]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{3.56013040044, 0.1773086442102, -2.10154538734}, 0.1]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{3.0764928252599995`, 0.32270472956799995`, 1.2950008819099998`}, 0.1]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{1.756908497816, 2.7607763024399996`, -0.734406105106}, 0.1]}, Text3DBox["1", {-0.807121528504, -0.826505681168, -0.8576162403059999}, {1, 0}], Text3DBox["2", {-2.65386760036, -0.0924153492766, 1.22422119458}, { 1, 0}], Text3DBox["3", {1.6091652830399998`, 0.7124191430959999, -0.58106239911}, {1, 0}], Text3DBox[ "4", {-1.673848137856, -0.43764542379199994`, -2.7341311658399996`}, {1, 0}], Text3DBox[ "5", {-0.356909426812, -2.8751614172199997`, -0.704506860334}, {1, 0}], Text3DBox["6", {-1.7854270095259999`, -0.48186123274, 3.09984983862}, {1, 0}], Text3DBox["7", {-4.42011890352, -1.2160651371639999`, 1.021419579712}, {1, 0}], Text3DBox["8", {-3.1053987308, 1.95645222506, 1.072795560474}, {1, 0}], Text3DBox["9", {2.9601304004399998`, 0.1773086442102, -2.10154538734}, {1, 0}], Text3DBox["10", {2.4764928252599994`, 0.32270472956799995`, 1.2950008819099998`}, {1, 0}], Text3DBox["11", {1.156908497816, 2.7607763024399996`, -0.734406105106}, {1, 0}], {RGBColor[0.84, 0.76, 0.6799999999999999], Opacity[0.6], SphereBox[{-1.1310399725718547`, -0.4592437128971163, 0.18391731590673954`}, 1.184195410557352]}, {RGBColor[0.84, 0.76, 0.6799999999999999], Opacity[0.6], SphereBox[{ 1.0017354988549156`, -0.056588765882654046`, -0.7192576428184523}, 1.1841786304880904`]}, {Opacity[0.5], SphereBox[{-0.8392477456641017, -0.5428998003207846, \ -2.2262072914208653`}, 1.2782678338426647`]}, {Opacity[0.5], SphereBox[{ 0.12122141712816967`, -2.3206051432516226`, -0.7459524608674054}, 1.2781223796070686`]}, {Opacity[0.5], SphereBox[{-1.4204885586903255`, -0.37644958610719703`, 2.5921718473118984`}, 1.2799926487529079`]}, {Opacity[0.5], SphereBox[{-3.3420202875173266`, -0.9119094332165882, 1.076315036104886}, 1.2798787862012264`]}, {Opacity[0.5], SphereBox[{-2.3831938600181344`, 1.401935425903823, 1.1137782276733876`}, 1.2801895820014826`]}, {Opacity[0.5], SphereBox[{3.194441976439778, 0.3221559925859477, -1.6899707134098017`}, 1.2798686836643025`]}, {Opacity[0.5], SphereBox[{2.8417301010055915`, 0.4281901580220122, 0.7871999586295056}, 1.2799707443399635`]}, {Opacity[0.5], SphereBox[{1.8793215345717125`, 2.206344332753992, -0.6929003293351661}, 1.2799873185053805`]}, TubeBox[{{-2.05386760036, -0.0924153492766, 1.22422119458}, {-0.20712152850399998`, -0.826505681168, \ -0.8576162403059999}}, 0.1], TubeBox[{{2.20916528304, 0.7124191430959999, -0.58106239911}, {-0.20712152850399998`, \ -0.826505681168, -0.8576162403059999}}, 0.1], TubeBox[{{-1.073848137856, -0.43764542379199994`, -2.7341311658399996`}, \ {-0.20712152850399998`, -0.826505681168, -0.8576162403059999}}, 0.1], TubeBox[{{ 0.24309057318799998`, -2.8751614172199997`, -0.704506860334}, \ {-0.20712152850399998`, -0.826505681168, -0.8576162403059999}}, 0.1], TubeBox[{{-1.185427009526, -0.48186123274, 3.09984983862}, {-2.05386760036, -0.0924153492766, 1.22422119458}}, 0.1], TubeBox[{{-3.8201189035199996`, -1.2160651371639999`, 1.021419579712}, {-2.05386760036, -0.0924153492766, 1.22422119458}}, 0.1], TubeBox[{{-2.5053987308, 1.95645222506, 1.072795560474}, {-2.05386760036, -0.0924153492766, 1.22422119458}}, 0.1], TubeBox[{{3.56013040044, 0.1773086442102, -2.10154538734}, {2.20916528304, 0.7124191430959999, -0.58106239911}}, 0.1], TubeBox[{{3.0764928252599995`, 0.32270472956799995`, 1.2950008819099998`}, {2.20916528304, 0.7124191430959999, -0.58106239911}}, 0.1], TubeBox[{{1.756908497816, 2.7607763024399996`, -0.734406105106}, { 2.20916528304, 0.7124191430959999, -0.58106239911}}, 0.1]}, AspectRatio->Automatic, Boxed->False, SphericalRegion->True]], "Output", CellChangeTimes->{3.5710449978218813`*^9, 3.5802161042929354`*^9}], Cell[BoxData[ Graphics3DBox[{ {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{-0.20712152850399998`, -0.826505681168, -0.8576162403059999}, 0.255]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{-2.05386760036, -0.0924153492766, 1.22422119458}, 0.255]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{2.20916528304, 0.7124191430959999, -0.58106239911}, 0.255]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{-1.073848137856, -0.43764542379199994`, -2.7341311658399996`}, 0.1]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{0.24309057318799998`, -2.8751614172199997`, -0.704506860334}, 0.1]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{-1.185427009526, -0.48186123274, 3.09984983862}, 0.1]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{-3.8201189035199996`, -1.2160651371639999`, 1.021419579712}, 0.1]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{-2.5053987308, 1.95645222506, 1.072795560474}, 0.1]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{3.56013040044, 0.1773086442102, -2.10154538734}, 0.1]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{3.0764928252599995`, 0.32270472956799995`, 1.2950008819099998`}, 0.1]}, {RGBColor[0.7333333333333333, 0.6, 0.4666666666666667], SphereBox[{1.756908497816, 2.7607763024399996`, -0.734406105106}, 0.1]}, Text3DBox["1", {-0.807121528504, -0.826505681168, -0.8576162403059999}, {1, 0}], Text3DBox["2", {-2.65386760036, -0.0924153492766, 1.22422119458}, { 1, 0}], Text3DBox["3", {1.6091652830399998`, 0.7124191430959999, -0.58106239911}, {1, 0}], Text3DBox[ "4", {-1.673848137856, -0.43764542379199994`, -2.7341311658399996`}, {1, 0}], Text3DBox[ "5", {-0.356909426812, -2.8751614172199997`, -0.704506860334}, {1, 0}], Text3DBox["6", {-1.7854270095259999`, -0.48186123274, 3.09984983862}, {1, 0}], Text3DBox["7", {-4.42011890352, -1.2160651371639999`, 1.021419579712}, {1, 0}], Text3DBox["8", {-3.1053987308, 1.95645222506, 1.072795560474}, {1, 0}], Text3DBox["9", {2.9601304004399998`, 0.1773086442102, -2.10154538734}, {1, 0}], Text3DBox["10", {2.4764928252599994`, 0.32270472956799995`, 1.2950008819099998`}, {1, 0}], Text3DBox["11", {1.156908497816, 2.7607763024399996`, -0.734406105106}, {1, 0}], TubeBox[{{-2.05386760036, -0.0924153492766, 1.22422119458}, {-0.20712152850399998`, -0.826505681168, \ -0.8576162403059999}}, 0.1], TubeBox[{{2.20916528304, 0.7124191430959999, -0.58106239911}, {-0.20712152850399998`, \ -0.826505681168, -0.8576162403059999}}, 0.1], TubeBox[{{-1.073848137856, -0.43764542379199994`, -2.7341311658399996`}, \ {-0.20712152850399998`, -0.826505681168, -0.8576162403059999}}, 0.1], TubeBox[{{ 0.24309057318799998`, -2.8751614172199997`, -0.704506860334}, \ {-0.20712152850399998`, -0.826505681168, -0.8576162403059999}}, 0.1], TubeBox[{{-1.185427009526, -0.48186123274, 3.09984983862}, {-2.05386760036, -0.0924153492766, 1.22422119458}}, 0.1], TubeBox[{{-3.8201189035199996`, -1.2160651371639999`, 1.021419579712}, {-2.05386760036, -0.0924153492766, 1.22422119458}}, 0.1], TubeBox[{{-2.5053987308, 1.95645222506, 1.072795560474}, {-2.05386760036, -0.0924153492766, 1.22422119458}}, 0.1], TubeBox[{{3.56013040044, 0.1773086442102, -2.10154538734}, {2.20916528304, 0.7124191430959999, -0.58106239911}}, 0.1], TubeBox[{{3.0764928252599995`, 0.32270472956799995`, 1.2950008819099998`}, {2.20916528304, 0.7124191430959999, -0.58106239911}}, 0.1], TubeBox[{{1.756908497816, 2.7607763024399996`, -0.734406105106}, { 2.20916528304, 0.7124191430959999, -0.58106239911}}, 0.1]}, AspectRatio->Automatic, Boxed->True, SphericalRegion->True]], "Output", CellChangeTimes->{3.5710449978218813`*^9, 3.580216104308535*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[{ RowBox[{ RowBox[{ RowBox[{"tc", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"{", RowBox[{ RowBox[{"x", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"y", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"z", "[", RowBox[{"[", "i", "]"}], "]"}]}], "}"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "bc"}], "}"}]}], "]"}]}], ";"}], " ", RowBox[{"(*", " ", RowBox[{"core", " ", "clouds"}], " ", "*)"}]}], "\[IndentingNewLine]", RowBox[{ RowBox[{ RowBox[{"twc", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"{", RowBox[{ RowBox[{"wxc", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"wyc", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"wzc", "[", RowBox[{"[", "i", "]"}], "]"}]}], "}"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "cw"}], "}"}]}], "]"}]}], ";"}], " ", RowBox[{"(*", " ", RowBox[{"Bond", " ", "c\[ODoubleDot]ouds", " ", "between", " ", "cores"}], " ", "*)"}]}], "\[IndentingNewLine]", RowBox[{ RowBox[{ RowBox[{"twh", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"{", RowBox[{ RowBox[{"wxh", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"wyh", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"wzh", "[", RowBox[{"[", "i", "]"}], "]"}]}], "}"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "bh"}], "}"}]}], "]"}]}], ";"}], " ", RowBox[{"(*", " ", RowBox[{"H", "-", RowBox[{"bonding", " ", "clouds"}]}], " ", "*)"}], " "}], "\[IndentingNewLine]", RowBox[{ RowBox[{"tw", "=", RowBox[{"Join", "[", RowBox[{"tc", ",", "twc", ",", "twh"}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{"bt", "=", RowBox[{"Length", "[", "tw", "]"}]}], "\[IndentingNewLine]", RowBox[{"MatrixForm", "[", "tw", "]"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"(*", " ", RowBox[{"coordinates", " ", "of", " ", "clouds"}], " ", "*)"}]}]}], "Input", CellChangeTimes->{{3.568895397419882*^9, 3.5688955157148895`*^9}, { 3.568895549629349*^9, 3.5688955855718126`*^9}, {3.568895617317868*^9, 3.568895845234268*^9}, {3.5688960797194805`*^9, 3.5688961015127187`*^9}, { 3.568896219074525*^9, 3.5688962276233397`*^9}, {3.568896262910602*^9, 3.5688962903198504`*^9}, 3.5688964250728865`*^9, 3.568896456912543*^9, { 3.5688981540863237`*^9, 3.5688981869399815`*^9}, {3.5689021233572955`*^9, 3.5689021341525145`*^9}, {3.5689111169043026`*^9, 3.5689111218495116`*^9}, {3.568911235261711*^9, 3.568911242437723*^9}, 3.5689112948850155`*^9, {3.5689116510180407`*^9, 3.568911800419503*^9}, { 3.568911871820829*^9, 3.5689119012892804`*^9}, {3.5689119993042526`*^9, 3.5689120006770554`*^9}, {3.568912144306507*^9, 3.568912165085744*^9}, { 3.5689528310632005`*^9, 3.5689528569592457`*^9}, {3.5689534065794115`*^9, 3.5689534297298517`*^9}, {3.568954496214126*^9, 3.5689545054337425`*^9}, 3.5689569073699613`*^9, {3.56913308739126*^9, 3.5691332012870607`*^9}, { 3.569135511323518*^9, 3.5691355127119203`*^9}, {3.569136204167535*^9, 3.569136290747687*^9}, {3.5691598050571885`*^9, 3.569159843199256*^9}, { 3.5692215417755947`*^9, 3.569221597186892*^9}, {3.5692216819730406`*^9, 3.5692217090546885`*^9}, {3.5692217693019943`*^9, 3.5692218260704937`*^9}, {3.5692219780303607`*^9, 3.569221989433981*^9}, { 3.569222055468897*^9, 3.5692220728005276`*^9}, {3.5693401536421804`*^9, 3.5693401889450426`*^9}, 3.5693411655535583`*^9, {3.569341634303181*^9, 3.569341638733589*^9}, {3.5704549882757435`*^9, 3.5704550487414494`*^9}, { 3.570455928146194*^9, 3.5704559415310173`*^9}, {3.5708553973857827`*^9, 3.5708554057785974`*^9}}], Cell[BoxData["13"], "Output", CellChangeTimes->{3.571044997853081*^9, 3.5802161043241353`*^9}], Cell[BoxData[ TagBox[ RowBox[{"(", "\[NoBreak]", GridBox[{ { RowBox[{"-", "0.20712152850399998`"}], RowBox[{"-", "0.826505681168`"}], RowBox[{"-", "0.8576162403059999`"}]}, { RowBox[{"-", "2.05386760036`"}], RowBox[{"-", "0.0924153492766`"}], "1.22422119458`"}, {"2.20916528304`", "0.7124191430959999`", RowBox[{"-", "0.58106239911`"}]}, { RowBox[{"-", "1.1310399725718547`"}], RowBox[{"-", "0.4592437128971163`"}], "0.18391731590673954`"}, {"1.0017354988549156`", RowBox[{"-", "0.056588765882654046`"}], RowBox[{"-", "0.7192576428184523`"}]}, { RowBox[{"-", "0.8392477456641017`"}], RowBox[{"-", "0.5428998003207846`"}], RowBox[{"-", "2.2262072914208653`"}]}, {"0.12122141712816967`", RowBox[{"-", "2.3206051432516226`"}], RowBox[{"-", "0.7459524608674054`"}]}, { RowBox[{"-", "1.4204885586903255`"}], RowBox[{"-", "0.37644958610719703`"}], "2.5921718473118984`"}, { RowBox[{"-", "3.3420202875173266`"}], RowBox[{"-", "0.9119094332165882`"}], "1.076315036104886`"}, { RowBox[{"-", "2.3831938600181344`"}], "1.401935425903823`", "1.1137782276733876`"}, {"3.194441976439778`", "0.3221559925859477`", RowBox[{"-", "1.6899707134098017`"}]}, {"2.8417301010055915`", "0.4281901580220122`", "0.7871999586295056`"}, {"1.8793215345717125`", "2.206344332753992`", RowBox[{"-", "0.6929003293351661`"}]} }, GridBoxAlignment->{ "Columns" -> {{Center}}, "ColumnsIndexed" -> {}, "Rows" -> {{Baseline}}, "RowsIndexed" -> {}}, GridBoxSpacings->{"Columns" -> { Offset[0.27999999999999997`], { Offset[0.7]}, Offset[0.27999999999999997`]}, "ColumnsIndexed" -> {}, "Rows" -> { Offset[0.2], { Offset[0.4]}, Offset[0.2]}, "RowsIndexed" -> {}}], "\[NoBreak]", ")"}], Function[BoxForm`e$, MatrixForm[BoxForm`e$]]]], "Output", CellChangeTimes->{3.571044997853081*^9, 3.5802161043241353`*^9}] }, Open ]], Cell[BoxData[ RowBox[{ RowBox[{"(*", " ", RowBox[{"cloud", "-", RowBox[{"cloud", " ", "distances"}]}], " ", "*)"}], "\[IndentingNewLine]", RowBox[{ RowBox[{ RowBox[{"dw", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"Sqrt", "[", RowBox[{ RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"tw", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "-", RowBox[{"tw", "[", RowBox[{"[", RowBox[{"j", ",", "1"}], "]"}], "]"}]}], ")"}], "^", "2"}], "+", RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"tw", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "-", RowBox[{"tw", "[", RowBox[{"[", RowBox[{"j", ",", "2"}], "]"}], "]"}]}], ")"}], "^", "2"}], "+", RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"tw", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}], "-", RowBox[{"tw", "[", RowBox[{"[", RowBox[{"j", ",", "3"}], "]"}], "]"}]}], ")"}], "^", "2"}]}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "bt"}], "}"}], ",", RowBox[{"{", RowBox[{"j", ",", "1", ",", "bt"}], "}"}]}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{"(*", RowBox[{"MatrixForm", "[", "dw", "]"}], "*)"}]}]}]], "Input", CellChangeTimes->{{3.5688982251756487`*^9, 3.5688986440675845`*^9}, { 3.5688986873108606`*^9, 3.56889871560931*^9}, {3.5688987970414534`*^9, 3.5688988526711507`*^9}, {3.568898887147211*^9, 3.568898888644814*^9}, { 3.5688989206248703`*^9, 3.568899041759083*^9}, {3.5688990876855636`*^9, 3.568899258349863*^9}, 3.568899300267137*^9, {3.568899351326027*^9, 3.5688993831032825`*^9}, {3.5688994370481772`*^9, 3.568899468217032*^9}, { 3.5688995813016305`*^9, 3.5688997165538683`*^9}, {3.5688998495129013`*^9, 3.568899932364647*^9}, {3.568899967667509*^9, 3.568900024529609*^9}, { 3.5689000794261055`*^9, 3.568900136257005*^9}, {3.5689001767858763`*^9, 3.56890020149632*^9}, {3.568902068726*^9, 3.568902074139209*^9}, 3.56890216040736*^9, 3.568902344113283*^9, {3.5689024237982235`*^9, 3.56890243907065*^9}, 3.5689025770684924`*^9, 3.568910195129884*^9, 3.568910620995032*^9, {3.568912393532545*^9, 3.5689124022841606`*^9}, { 3.5691332074958715`*^9, 3.5691332081666727`*^9}, {3.5691352237838125`*^9, 3.5691352313342257`*^9}, {3.5691489965881166`*^9, 3.5691490103317413`*^9}, {3.5691490440122004`*^9, 3.5691491351943607`*^9}, {3.569149201666077*^9, 3.5691492026956787`*^9}, { 3.5691494320784817`*^9, 3.5691494680989447`*^9}, {3.569152288984131*^9, 3.5691522953957424`*^9}, {3.5691595058486633`*^9, 3.569159537672719*^9}, 3.569237911685565*^9, 3.5693411655535583`*^9, 3.5693418217687106`*^9, { 3.5703410302061863`*^9, 3.570341063621445*^9}}], Cell[BoxData[ RowBox[{ RowBox[{"(*", " ", RowBox[{"nucleus", "-", RowBox[{"nucleus", " ", "distances"}]}], " ", "*)"}], "\[IndentingNewLine]", RowBox[{"(*", RowBox[{"MatrixForm", "[", "dc", "]"}], " ", "*)"}], " "}]], "Input", CellChangeTimes->{{3.5688982251756487`*^9, 3.5688986440675845`*^9}, { 3.5688986873108606`*^9, 3.56889871560931*^9}, {3.5688987970414534`*^9, 3.5688988526711507`*^9}, {3.568898887147211*^9, 3.568898888644814*^9}, { 3.5688989206248703`*^9, 3.568899041759083*^9}, {3.5688990876855636`*^9, 3.568899258349863*^9}, 3.568899300267137*^9, {3.568899351326027*^9, 3.5688993831032825`*^9}, {3.5688994370481772`*^9, 3.568899468217032*^9}, { 3.5688995813016305`*^9, 3.5688997165538683`*^9}, {3.5688998495129013`*^9, 3.568899932364647*^9}, {3.568899967667509*^9, 3.568900024529609*^9}, { 3.5689000794261055`*^9, 3.568900136257005*^9}, {3.5689001767858763`*^9, 3.56890020149632*^9}, {3.568902068726*^9, 3.568902074139209*^9}, 3.56890216040736*^9, 3.568902344113283*^9, {3.5689024237982235`*^9, 3.56890243907065*^9}, 3.5689025770684924`*^9, 3.568910195129884*^9, 3.568910620995032*^9, {3.568912393532545*^9, 3.5689124022841606`*^9}, { 3.5691332074958715`*^9, 3.5691332081666727`*^9}, {3.5691352237838125`*^9, 3.5691352313342257`*^9}, {3.5691489965881166`*^9, 3.5691490103317413`*^9}, {3.5691490440122004`*^9, 3.5691491273631463`*^9}, {3.5691523435842266`*^9, 3.56915234531583*^9}, { 3.5691524837816734`*^9, 3.569152599175076*^9}, {3.569159470889002*^9, 3.569159489874235*^9}, {3.569160442895509*^9, 3.5691604484335184`*^9}, 3.569237923385586*^9, 3.569341165569158*^9, 3.5693418217843103`*^9, { 3.570341048161818*^9, 3.570341058286236*^9}, {3.57034131095988*^9, 3.570341315156287*^9}, 3.5703415891395683`*^9, 3.570341976207448*^9}], Cell[CellGroupData[{ Cell[BoxData[{ RowBox[{ RowBox[{"tv1", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"{", RowBox[{ RowBox[{"x", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"y", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"z", "[", RowBox[{"[", "i", "]"}], "]"}]}], "}"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "bc"}], "}"}]}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"tv2", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"{", RowBox[{"0", ",", "0", ",", "0"}], "}"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "cw"}], "}"}]}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"tv3", "=", " ", RowBox[{"Table", "[", RowBox[{ RowBox[{"{", RowBox[{ RowBox[{"x", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"y", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"z", "[", RowBox[{"[", "i", "]"}], "]"}]}], "}"}], ",", RowBox[{"{", RowBox[{"i", ",", RowBox[{"bc", "+", "1"}], ",", "n"}], "}"}]}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"tv", " ", "=", " ", RowBox[{"Join", "[", RowBox[{"tv1", ",", "tv2", ",", "tv3"}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{"MatrixForm", "[", "tv", "]"}]}], "Input", CellChangeTimes->{{3.5688982251756487`*^9, 3.5688986440675845`*^9}, { 3.5688986873108606`*^9, 3.56889871560931*^9}, {3.5688987970414534`*^9, 3.5688988526711507`*^9}, {3.568898887147211*^9, 3.568898888644814*^9}, { 3.5688989206248703`*^9, 3.568899041759083*^9}, {3.5688990876855636`*^9, 3.568899258349863*^9}, 3.568899300267137*^9, {3.568899351326027*^9, 3.5688993831032825`*^9}, {3.5688994370481772`*^9, 3.568899468217032*^9}, { 3.5688995813016305`*^9, 3.5688997165538683`*^9}, {3.5688998495129013`*^9, 3.568899932364647*^9}, {3.568899967667509*^9, 3.568900024529609*^9}, { 3.5689000794261055`*^9, 3.568900136257005*^9}, {3.5689001767858763`*^9, 3.56890020149632*^9}, {3.568902068726*^9, 3.568902074139209*^9}, 3.56890216040736*^9, 3.568902344113283*^9, {3.5689024237982235`*^9, 3.56890243907065*^9}, 3.5689025770684924`*^9, 3.568910195129884*^9, 3.568910620995032*^9, {3.568912393532545*^9, 3.5689124022841606`*^9}, { 3.5691332074958715`*^9, 3.5691332081666727`*^9}, {3.5691352237838125`*^9, 3.5691352313342257`*^9}, {3.5691489965881166`*^9, 3.5691490103317413`*^9}, {3.5691490440122004`*^9, 3.5691491273631463`*^9}, {3.5691523435842266`*^9, 3.56915234531583*^9}, { 3.5691524837816734`*^9, 3.5691526041202846`*^9}, {3.5691595921324143`*^9, 3.5691596901941867`*^9}, {3.569159772406331*^9, 3.5691597832951508`*^9}, { 3.5691598700313025`*^9, 3.569159885147729*^9}, {3.569160485733184*^9, 3.569160486887586*^9}, {3.5691672792073207`*^9, 3.5691672793789206`*^9}, { 3.5691673418102303`*^9, 3.5691674875144863`*^9}, {3.569168259700243*^9, 3.569168260386644*^9}, {3.569168321257951*^9, 3.569168337466379*^9}, { 3.5691685152754917`*^9, 3.569168656096939*^9}, {3.5691687137702403`*^9, 3.569168772566744*^9}, {3.5691697249898825`*^9, 3.569169747063921*^9}, { 3.569169944981469*^9, 3.5691699696763124`*^9}, 3.569341165569158*^9, { 3.5693417833614435`*^9, 3.5693417874486504`*^9}, {3.5704552110753345`*^9, 3.5704552378605814`*^9}, {3.5704560776724567`*^9, 3.570456083070066*^9}, { 3.570855427306635*^9, 3.570855434529448*^9}}], Cell[BoxData[ TagBox[ RowBox[{"(", "\[NoBreak]", GridBox[{ { RowBox[{"-", "0.20712152850399998`"}], RowBox[{"-", "0.826505681168`"}], RowBox[{"-", "0.8576162403059999`"}]}, { RowBox[{"-", "2.05386760036`"}], RowBox[{"-", "0.0924153492766`"}], "1.22422119458`"}, {"2.20916528304`", "0.7124191430959999`", RowBox[{"-", "0.58106239911`"}]}, {"0", "0", "0"}, {"0", "0", "0"}, { RowBox[{"-", "1.073848137856`"}], RowBox[{"-", "0.43764542379199994`"}], RowBox[{"-", "2.7341311658399996`"}]}, {"0.24309057318799998`", RowBox[{"-", "2.8751614172199997`"}], RowBox[{"-", "0.704506860334`"}]}, { RowBox[{"-", "1.185427009526`"}], RowBox[{"-", "0.48186123274`"}], "3.09984983862`"}, { RowBox[{"-", "3.8201189035199996`"}], RowBox[{"-", "1.2160651371639999`"}], "1.021419579712`"}, { RowBox[{"-", "2.5053987308`"}], "1.95645222506`", "1.072795560474`"}, {"3.56013040044`", "0.1773086442102`", RowBox[{"-", "2.10154538734`"}]}, {"3.0764928252599995`", "0.32270472956799995`", "1.2950008819099998`"}, {"1.756908497816`", "2.7607763024399996`", RowBox[{"-", "0.734406105106`"}]} }, GridBoxAlignment->{ "Columns" -> {{Center}}, "ColumnsIndexed" -> {}, "Rows" -> {{Baseline}}, "RowsIndexed" -> {}}, GridBoxSpacings->{"Columns" -> { Offset[0.27999999999999997`], { Offset[0.7]}, Offset[0.27999999999999997`]}, "ColumnsIndexed" -> {}, "Rows" -> { Offset[0.2], { Offset[0.4]}, Offset[0.2]}, "RowsIndexed" -> {}}], "\[NoBreak]", ")"}], Function[BoxForm`e$, MatrixForm[BoxForm`e$]]]], "Output", CellChangeTimes->{3.571044997868681*^9, 3.580216104355335*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{"\[IndentingNewLine]", RowBox[{ RowBox[{"ow", "=", RowBox[{"Join", "[", RowBox[{"Table", "[", RowBox[{ RowBox[{"-", "2.0"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", RowBox[{"bc", "+", "nb"}]}], "}"}]}], "]"}], "]"}]}], RowBox[{"(*", " ", RowBox[{"nucleus", "-", RowBox[{"cloud", " ", "distances"}]}], " ", "*)"}], "\[IndentingNewLine]", RowBox[{"cnv", "=", RowBox[{"Join", "[", RowBox[{ RowBox[{"Table", "[", RowBox[{ RowBox[{"cn", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "bc"}], "}"}]}], "]"}], ",", RowBox[{"Table", "[", RowBox[{"0.0", ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "cw"}], "}"}]}], "]"}], ",", RowBox[{"Table", "[", RowBox[{ RowBox[{"cn", "[", RowBox[{"[", "i", "]"}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", RowBox[{"bc", "+", "1"}], ",", "n"}], "}"}]}], "]"}]}], "]"}]}], "\[IndentingNewLine]", RowBox[{ RowBox[{"dcw", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{ RowBox[{"sq", "=", RowBox[{"Sqrt", "[", RowBox[{ RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"tw", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "-", RowBox[{"tv", "[", RowBox[{"[", RowBox[{"j", ",", "1"}], "]"}], "]"}]}], ")"}], "^", "2"}], "+", RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"tw", "[", RowBox[{"[", RowBox[{"i", ",", "2"}], "]"}], "]"}], "-", RowBox[{"tv", "[", RowBox[{"[", RowBox[{"j", ",", "2"}], "]"}], "]"}]}], ")"}], "^", "2"}], "+", RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"tw", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}], "-", RowBox[{"tv", "[", RowBox[{"[", RowBox[{"j", ",", "3"}], "]"}], "]"}]}], ")"}], "^", "2"}]}], "]"}]}], ";", RowBox[{"If", "[", RowBox[{ RowBox[{"sq", ">", " ", "0.1"}], ",", StyleBox[ RowBox[{"1", "/", "sq"}], FontColor->RGBColor[1, 0, 0]], ",", "0"}], "]"}]}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "bt"}], "}"}], ",", RowBox[{"{", RowBox[{"j", ",", "1", ",", "bt"}], "}"}]}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"dcw", "=", RowBox[{"Table", "[", RowBox[{ RowBox[{"If", "[", RowBox[{ RowBox[{"i", "\[Equal]", " ", "j"}], ",", RowBox[{ RowBox[{"dcw", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}], "=", "0.0"}], ",", RowBox[{"dcw", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}]}], "]"}], ",", RowBox[{"{", RowBox[{"i", ",", "1", ",", "bt"}], "}"}], ",", RowBox[{"{", RowBox[{"j", ",", "1", ",", "bt"}], "}"}]}], "]"}]}], ";"}], "\[IndentingNewLine]", RowBox[{"(*", RowBox[{"MatrixForm", "[", "dcw", "]"}], "*)"}], " "}]}]], "Input", CellChangeTimes->{{3.5688982251756487`*^9, 3.5688986440675845`*^9}, { 3.5688986873108606`*^9, 3.56889871560931*^9}, {3.5688987970414534`*^9, 3.5688988526711507`*^9}, {3.568898887147211*^9, 3.568898888644814*^9}, { 3.5688989206248703`*^9, 3.568899041759083*^9}, {3.5688990876855636`*^9, 3.568899258349863*^9}, 3.568899300267137*^9, {3.568899351326027*^9, 3.5688993831032825`*^9}, {3.5688994370481772`*^9, 3.568899468217032*^9}, { 3.5688995813016305`*^9, 3.5688997165538683`*^9}, {3.5688998495129013`*^9, 3.568899932364647*^9}, {3.568899967667509*^9, 3.568900024529609*^9}, { 3.5689000794261055`*^9, 3.568900136257005*^9}, {3.5689001767858763`*^9, 3.56890020149632*^9}, {3.568902068726*^9, 3.568902074139209*^9}, 3.56890216040736*^9, 3.568902344113283*^9, {3.5689024237982235`*^9, 3.56890243907065*^9}, 3.5689025770684924`*^9, 3.568910195129884*^9, 3.568910620995032*^9, {3.568912393532545*^9, 3.5689124022841606`*^9}, { 3.5691332074958715`*^9, 3.5691332081666727`*^9}, {3.5691352237838125`*^9, 3.5691352313342257`*^9}, {3.5691489965881166`*^9, 3.5691490103317413`*^9}, {3.5691490440122004`*^9, 3.5691491273631463`*^9}, {3.5691523435842266`*^9, 3.56915234531583*^9}, { 3.5691524837816734`*^9, 3.5691526041202846`*^9}, {3.5691595921324143`*^9, 3.5691596901941867`*^9}, {3.569159772406331*^9, 3.5691597832951508`*^9}, { 3.5691598700313025`*^9, 3.569159885147729*^9}, {3.569160485733184*^9, 3.569160486887586*^9}, {3.5691672792073207`*^9, 3.5691672793789206`*^9}, { 3.5691673418102303`*^9, 3.5691674875144863`*^9}, {3.569168259700243*^9, 3.569168260386644*^9}, {3.569168321257951*^9, 3.569168337466379*^9}, { 3.5691685152754917`*^9, 3.569168656096939*^9}, {3.5691687137702403`*^9, 3.569168772566744*^9}, {3.5691697249898825`*^9, 3.569169747063921*^9}, { 3.569169944981469*^9, 3.5691699655579047`*^9}, {3.56921753575448*^9, 3.569217541807291*^9}, {3.569217576283351*^9, 3.5692176436130695`*^9}, { 3.5692176921603546`*^9, 3.569217692768756*^9}, {3.5692177389136367`*^9, 3.569217740192839*^9}, {3.5692222042775583`*^9, 3.5692222070231633`*^9}, { 3.569230669979245*^9, 3.5692306709620466`*^9}, {3.5692308816872168`*^9, 3.5692309970650196`*^9}, {3.5692310297158766`*^9, 3.569231090602784*^9}, { 3.5692311251880445`*^9, 3.569231148868886*^9}, 3.56923793753481*^9, 3.569341165569158*^9, 3.5693418217375107`*^9, {3.5703412254249296`*^9, 3.5703412423509593`*^9}, {3.5704553045038986`*^9, 3.570455320681127*^9}, { 3.57045550485505*^9, 3.5704555063370533`*^9}, {3.5704556421508913`*^9, 3.5704556424784923`*^9}, 3.5704557137862177`*^9, {3.5704564711051474`*^9, 3.5704564908079824`*^9}, {3.570456521602436*^9, 3.5704565228348384`*^9}, { 3.5704569127419233`*^9, 3.5704569202767363`*^9}, 3.5704636205455036`*^9, 3.570596993178934*^9, {3.570855461377095*^9, 3.5708554743563175`*^9}, 3.570855611589759*^9}], Cell[BoxData[ RowBox[{"{", RowBox[{ RowBox[{"-", "2.`"}], ",", RowBox[{"-", "2.`"}], ",", RowBox[{"-", "2.`"}], ",", RowBox[{"-", "2.`"}], ",", RowBox[{"-", "2.`"}], ",", RowBox[{"-", "2.`"}], ",", RowBox[{"-", "2.`"}], ",", RowBox[{"-", "2.`"}], ",", RowBox[{"-", "2.`"}], ",", RowBox[{"-", "2.`"}], ",", RowBox[{"-", "2.`"}], ",", RowBox[{"-", "2.`"}], ",", RowBox[{"-", "2.`"}]}], "}"}]], "Output", CellChangeTimes->{3.571044997884281*^9, 3.5802161043709354`*^9}], Cell[BoxData[ RowBox[{"{", RowBox[{ "6.`", ",", "6.`", ",", "6.`", ",", "0.`", ",", "0.`", ",", "1.`", ",", "1.`", ",", "1.`", ",", "1.`", ",", "1.`", ",", "1.`", ",", "1.`", ",", "1.`"}], "}"}]], "Output", CellChangeTimes->{3.571044997884281*^9, 3.5802161043709354`*^9}] }, Open ]], Cell[BoxData[ RowBox[{ RowBox[{"Vee", "=", "0.0"}], ";", " ", RowBox[{"Vnn", "=", "0.0"}], ";"}]], "Input", CellChangeTimes->{{3.5688982251756487`*^9, 3.5688986440675845`*^9}, { 3.5688986873108606`*^9, 3.56889871560931*^9}, {3.5688987970414534`*^9, 3.5688988526711507`*^9}, {3.568898887147211*^9, 3.568898888644814*^9}, { 3.5688989206248703`*^9, 3.568899041759083*^9}, {3.5688990876855636`*^9, 3.568899258349863*^9}, 3.568899300267137*^9, {3.568899351326027*^9, 3.5688993831032825`*^9}, {3.5688994370481772`*^9, 3.568899468217032*^9}, { 3.5688995813016305`*^9, 3.5688997165538683`*^9}, {3.5688998495129013`*^9, 3.568899932364647*^9}, {3.568899967667509*^9, 3.568900024529609*^9}, { 3.5689000794261055`*^9, 3.568900136257005*^9}, {3.5689001767858763`*^9, 3.56890020149632*^9}, {3.568902068726*^9, 3.568902074139209*^9}, 3.56890216040736*^9, 3.568902344113283*^9, {3.5689024237982235`*^9, 3.56890243907065*^9}, 3.5689025770684924`*^9, {3.568910195129884*^9, 3.568910199825492*^9}, 3.568910617609826*^9, {3.56891263539537*^9, 3.568912638842976*^9}, {3.568952611212014*^9, 3.5689526227248344`*^9}, { 3.5689527476498537`*^9, 3.5689527480086546`*^9}, {3.5689530637688093`*^9, 3.5689530642368097`*^9}, {3.569133363948546*^9, 3.569133373698563*^9}, { 3.5691350563331184`*^9, 3.56913505725352*^9}, 3.5691351502452836`*^9, { 3.569135237792637*^9, 3.5691352453118505`*^9}, {3.5691353071659594`*^9, 3.5691353166039753`*^9}, {3.5691447439722476`*^9, 3.5691448093675623`*^9}, {3.569146067386572*^9, 3.569146078244191*^9}, { 3.5691478509845047`*^9, 3.5691478547909117`*^9}, {3.569159874789311*^9, 3.56915988004652*^9}, {3.5691671967299757`*^9, 3.569167196901576*^9}, 3.5691672337020407`*^9, {3.5691672688489027`*^9, 3.5691672717661076`*^9}, 3.569171387282002*^9, 3.5692335989467897`*^9}], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{ RowBox[{"(*", " ", RowBox[{"all", " ", "clouds", " ", "repulsion"}], " ", "*)"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"For", "[", RowBox[{ RowBox[{"i", "=", "1"}], ",", RowBox[{"i", "<", "bt"}], ",", RowBox[{"i", "++"}], ",", "\[IndentingNewLine]", RowBox[{"For", "[", RowBox[{ RowBox[{"j", "=", RowBox[{"i", "+", "1"}]}], ",", RowBox[{"j", "<", RowBox[{"bt", "+", "1"}]}], ",", RowBox[{"j", "++"}], ",", "\[IndentingNewLine]", RowBox[{"Vee", "=", RowBox[{"Vee", "+", RowBox[{ RowBox[{"ow", "[", RowBox[{"[", "i", "]"}], "]"}], "*", RowBox[{ RowBox[{"ow", "[", RowBox[{"[", "j", "]"}], "]"}], "/", RowBox[{"dw", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}]}]}]}]}]}], "]"}]}], "]"}], "\[IndentingNewLine]", "Vee"}]}]], "Input", CellChangeTimes->{{3.5688982251756487`*^9, 3.5688986440675845`*^9}, { 3.5688986873108606`*^9, 3.56889871560931*^9}, {3.5688987970414534`*^9, 3.5688988526711507`*^9}, {3.568898887147211*^9, 3.568898888644814*^9}, { 3.5688989206248703`*^9, 3.568899041759083*^9}, {3.5688990876855636`*^9, 3.568899258349863*^9}, 3.568899300267137*^9, {3.568899351326027*^9, 3.5688993831032825`*^9}, {3.5688994370481772`*^9, 3.568899468217032*^9}, { 3.5688995813016305`*^9, 3.5688997165538683`*^9}, {3.5688998495129013`*^9, 3.568899932364647*^9}, {3.568899967667509*^9, 3.568900024529609*^9}, { 3.5689000794261055`*^9, 3.568900136257005*^9}, {3.5689001767858763`*^9, 3.56890020149632*^9}, {3.568902068726*^9, 3.568902074139209*^9}, 3.56890216040736*^9, 3.568902344113283*^9, {3.5689024237982235`*^9, 3.56890243907065*^9}, 3.5689025770684924`*^9, {3.568910195129884*^9, 3.568910199825492*^9}, 3.568910617609826*^9, {3.56891263539537*^9, 3.568912638842976*^9}, {3.568952611212014*^9, 3.5689526227248344`*^9}, { 3.5689527476498537`*^9, 3.5689527480086546`*^9}, {3.5689530637688093`*^9, 3.5689530642368097`*^9}, {3.569133363948546*^9, 3.569133373698563*^9}, { 3.5691350563331184`*^9, 3.56913505725352*^9}, 3.5691351502452836`*^9, { 3.569135237792637*^9, 3.5691352453118505`*^9}, {3.5691353071659594`*^9, 3.5691353166039753`*^9}, {3.5691447439722476`*^9, 3.5691448093675623`*^9}, {3.569146067386572*^9, 3.569146078244191*^9}, { 3.5691478509845047`*^9, 3.5691478969889855`*^9}, {3.569149270524598*^9, 3.569149283675421*^9}, {3.5691523005437512`*^9, 3.5691523013861527`*^9}, { 3.570457123841494*^9, 3.5704571330923104`*^9}, {3.570457176959587*^9, 3.570457191296013*^9}, {3.570463789649801*^9, 3.570463797637015*^9}, { 3.5704639300032473`*^9, 3.5704639472412777`*^9}, {3.570464099403945*^9, 3.5704641196371803`*^9}, {3.570464183737693*^9, 3.5704641855628963`*^9}, { 3.570855532092019*^9, 3.5708555433240385`*^9}}], Cell[BoxData["105.42972499906948`"], "Output", CellChangeTimes->{3.571044997915481*^9, 3.580216104386535*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[{ RowBox[{ RowBox[{ RowBox[{"sc", "=", "0.4118"}], ";"}], " ", RowBox[{"(*", " ", RowBox[{"core", " ", "clouds"}], " ", "*)"}]}], "\[IndentingNewLine]", RowBox[{"For", "[", RowBox[{ RowBox[{"i", "=", "1"}], " ", ",", RowBox[{"i", "<", RowBox[{"bc", "+", "1"}]}], ",", RowBox[{"i", "++"}], ",", RowBox[{"Vee", "=", RowBox[{"Vee", "+", RowBox[{"3", "*", RowBox[{"sc", "/", RowBox[{"u2", "[", RowBox[{"[", "i", "]"}], "]"}]}]}]}]}]}], "]"}], "\[IndentingNewLine]", RowBox[{ RowBox[{ RowBox[{"sw", "=", "0.4246"}], ";"}], " ", RowBox[{"(*", " ", RowBox[{"bonding", " ", "clouds"}], " ", "*)"}]}], "\[IndentingNewLine]", RowBox[{"For", "[", RowBox[{ RowBox[{"i", "=", "1"}], " ", ",", RowBox[{"i", "<", RowBox[{"nb", "+", "1"}]}], ",", RowBox[{"i", "++"}], ",", RowBox[{"Vee", "=", RowBox[{"Vee", "+", RowBox[{"3", "*", RowBox[{"sw", "/", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}]}]}]}]}]}], "]"}], "\[IndentingNewLine]", "Vee"}], "Input", CellChangeTimes->{{3.5689548890696163`*^9, 3.568955116299615*^9}, { 3.5689552553894596`*^9, 3.5689552575266633`*^9}, {3.5689552936875267`*^9, 3.5689553203323736`*^9}, {3.568955404229321*^9, 3.568955433245372*^9}, 3.5689554882822685`*^9, 3.5689562157115464`*^9, {3.568956283961666*^9, 3.5689562858180695`*^9}, {3.5689566111878405`*^9, 3.5689566291278725`*^9}, {3.5689566695319433`*^9, 3.5689567220104356`*^9}, {3.5690810958835616`*^9, 3.569081104525977*^9}, { 3.5691717160681796`*^9, 3.569171751714242*^9}, {3.5691717855663013`*^9, 3.5691719006789036`*^9}, 3.569234247377528*^9, {3.569235622381544*^9, 3.569235625142749*^9}, {3.5692356799612455`*^9, 3.569235740536152*^9}, { 3.57045575500149*^9, 3.5704557604770994`*^9}, {3.57046440981329*^9, 3.5704644333849316`*^9}, {3.5705963024877205`*^9, 3.5705963300061693`*^9}, {3.5706010463712544`*^9, 3.570601069225295*^9}, { 3.5706012097659416`*^9, 3.5706012109983435`*^9}, {3.570601290948484*^9, 3.570601291619285*^9}, {3.570601333099758*^9, 3.570601444951955*^9}, 3.5706014761208096`*^9, {3.570601526633698*^9, 3.570601615179454*^9}, { 3.5708576202336864`*^9, 3.5708576267544985`*^9}, {3.5708577990100007`*^9, 3.5708578016152053`*^9}, {3.5708580423548284`*^9, 3.570858044429632*^9}, { 3.570858075754487*^9, 3.5708581072821426`*^9}, {3.570858449889944*^9, 3.5708585756105647`*^9}, {3.5710442384281473`*^9, 3.571044290017438*^9}, { 3.571044322761895*^9, 3.5710446121424036`*^9}, {3.5710446451208615`*^9, 3.571044670751707*^9}}], Cell[BoxData["130.1042242781981`"], "Output", CellChangeTimes->{3.5710449979310813`*^9, 3.580216104402135*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{ RowBox[{"(*", " ", RowBox[{ RowBox[{"all", " ", "nuclei", " ", "with", " ", "all", " ", "clouds"}], ",", " ", RowBox[{ RowBox[{"except", " ", "i"}], " ", "=", " ", "j"}]}], " ", "*)"}], "\[IndentingNewLine]", RowBox[{"Vne", "=", RowBox[{"cnv", ".", RowBox[{"(", RowBox[{"ow", ".", "dcw"}], ")"}]}]}]}]], "Input", CellChangeTimes->{ 3.569233528637466*^9, 3.5692342309507*^9, {3.5704557844231415`*^9, 3.570455793127957*^9}}], Cell[BoxData[ RowBox[{"-", "220.28209345839622`"}]], "Output", CellChangeTimes->{3.5710449979310813`*^9, 3.580216104417735*^9}] }, Open ]], Cell[BoxData[ RowBox[{"(*", " ", RowBox[{ "core", " ", "nuclei", " ", "in", " ", "their", " ", "cloud", " ", "centers"}], " ", "*)"}]], "Input", CellChangeTimes->{{3.5688982251756487`*^9, 3.5688986440675845`*^9}, { 3.5688986873108606`*^9, 3.56889871560931*^9}, {3.5688987970414534`*^9, 3.5688988526711507`*^9}, {3.568898887147211*^9, 3.568898888644814*^9}, { 3.5688989206248703`*^9, 3.568899041759083*^9}, {3.5688990876855636`*^9, 3.568899258349863*^9}, 3.568899300267137*^9, {3.568899351326027*^9, 3.5688993831032825`*^9}, {3.5688994370481772`*^9, 3.568899468217032*^9}, { 3.5688995813016305`*^9, 3.5688997165538683`*^9}, {3.5688998495129013`*^9, 3.568899932364647*^9}, {3.568899967667509*^9, 3.568900024529609*^9}, { 3.5689000794261055`*^9, 3.568900136257005*^9}, {3.5689001767858763`*^9, 3.56890020149632*^9}, {3.568902068726*^9, 3.568902074139209*^9}, 3.56890216040736*^9, 3.568902344113283*^9, {3.5689024237982235`*^9, 3.56890243907065*^9}, 3.5689025770684924`*^9, {3.568910195129884*^9, 3.5689102262831383`*^9}, {3.5689126851126575`*^9, 3.5689126875306616`*^9}, {3.5690878255169816`*^9, 3.569087857185037*^9}, { 3.5691452963224173`*^9, 3.569145370484948*^9}, {3.5691454640695124`*^9, 3.5691454653799143`*^9}, {3.5691523784970884`*^9, 3.569152451988817*^9}, { 3.569152629610729*^9, 3.5691526609667845`*^9}}], Cell[CellGroupData[{ Cell[BoxData[{ RowBox[{"For", "[", RowBox[{ RowBox[{"i", "=", "1"}], ",", RowBox[{"i", "<", RowBox[{"bc", "+", "1"}]}], ",", RowBox[{"i", "++"}], ",", RowBox[{"Vne", "=", RowBox[{"Vne", "-", RowBox[{"3", "*", RowBox[{ RowBox[{"cn", "[", RowBox[{"[", "i", "]"}], "]"}], "/", RowBox[{"u2", "[", RowBox[{"[", "i", "]"}], "]"}]}]}]}]}]}], "]"}], "\[IndentingNewLine]", "Vne"}], "Input", CellChangeTimes->{{3.5688982251756487`*^9, 3.5688986440675845`*^9}, { 3.5688986873108606`*^9, 3.56889871560931*^9}, {3.5688987970414534`*^9, 3.5688988526711507`*^9}, {3.568898887147211*^9, 3.568898888644814*^9}, { 3.5688989206248703`*^9, 3.568899041759083*^9}, {3.5688990876855636`*^9, 3.568899258349863*^9}, 3.568899300267137*^9, {3.568899351326027*^9, 3.5688993831032825`*^9}, {3.5688994370481772`*^9, 3.568899468217032*^9}, { 3.5688995813016305`*^9, 3.5688997165538683`*^9}, {3.5688998495129013`*^9, 3.568899932364647*^9}, {3.568899967667509*^9, 3.568900024529609*^9}, { 3.5689000794261055`*^9, 3.568900136257005*^9}, {3.5689001767858763`*^9, 3.56890020149632*^9}, {3.568902068726*^9, 3.568902074139209*^9}, 3.56890216040736*^9, 3.568902344113283*^9, {3.5689024237982235`*^9, 3.56890243907065*^9}, 3.5689025770684924`*^9, {3.568910195129884*^9, 3.5689102262831383`*^9}, {3.5689126851126575`*^9, 3.5689126875306616`*^9}, {3.5690878255169816`*^9, 3.569087857185037*^9}, { 3.5691452963224173`*^9, 3.569145370484948*^9}, {3.5691454640695124`*^9, 3.5691454653799143`*^9}, {3.5691523784970884`*^9, 3.569152451988817*^9}, { 3.569152629610729*^9, 3.5691526649915915`*^9}, 3.569170044088443*^9}], Cell[BoxData[ RowBox[{"-", "432.40937105671367`"}]], "Output", CellChangeTimes->{3.571044997962281*^9, 3.5802161044333353`*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{ RowBox[{"(*", " ", RowBox[{ RowBox[{ "protons", " ", "in", " ", "their", " ", "bonding", " ", "cloud"}], ",", " ", RowBox[{"distance", " ", RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}], " ", "to", " ", "cloud", " ", "center"}]}], " ", "*)"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"For", "[", RowBox[{ RowBox[{"i", "=", RowBox[{"cw", "+", "1"}]}], ",", RowBox[{"i", "<", RowBox[{"nb", "+", "1"}]}], ",", RowBox[{"i", "++"}], ",", RowBox[{"Vne", "=", RowBox[{"Vne", "-", RowBox[{ RowBox[{"(", RowBox[{"3", "-", RowBox[{ RowBox[{"(", RowBox[{ RowBox[{"u2", "[", RowBox[{"[", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "1"}], "]"}], "]"}], "]"}], "]"}], "/", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}]}], ")"}], "^", "2"}]}], ")"}], "/", RowBox[{"a", "[", RowBox[{"[", RowBox[{"i", ",", "3"}], "]"}], "]"}]}]}]}]}], "]"}], "\[IndentingNewLine]", "Vne"}]}]], "Input", CellChangeTimes->{{3.5692316245917215`*^9, 3.5692316336397376`*^9}}], Cell[BoxData[ RowBox[{"-", "449.9284909439605`"}]], "Output", CellChangeTimes->{3.5710449979778814`*^9, 3.5802161044489355`*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{ RowBox[{"(*", " ", RowBox[{"nucleus", "-", "nucleus"}], " ", "*)"}], "\[IndentingNewLine]", RowBox[{ RowBox[{"For", "[", RowBox[{ RowBox[{"i", "=", "1"}], ",", RowBox[{"i", "<", "n"}], ",", RowBox[{"i", "++"}], ",", "\[IndentingNewLine]", RowBox[{"For", "[", RowBox[{ RowBox[{"j", "=", RowBox[{"i", "+", "1"}]}], ",", RowBox[{"j", "<", RowBox[{"n", "+", "1"}]}], ",", RowBox[{"j", "++"}], ",", RowBox[{"Vnn", "=", RowBox[{"Vnn", "+", RowBox[{ RowBox[{"cn", "[", RowBox[{"[", "i", "]"}], "]"}], "*", RowBox[{ RowBox[{"cn", "[", RowBox[{"[", "j", "]"}], "]"}], "/", RowBox[{"dc", "[", RowBox[{"[", RowBox[{"i", ",", "j"}], "]"}], "]"}]}]}]}]}]}], "]"}]}], "]"}], "\[IndentingNewLine]", "Vnn"}]}]], "Input", CellChangeTimes->{{3.5688982251756487`*^9, 3.5688986440675845`*^9}, { 3.5688986873108606`*^9, 3.56889871560931*^9}, {3.5688987970414534`*^9, 3.5688988526711507`*^9}, {3.568898887147211*^9, 3.568898888644814*^9}, { 3.5688989206248703`*^9, 3.568899041759083*^9}, {3.5688990876855636`*^9, 3.568899258349863*^9}, 3.568899300267137*^9, {3.568899351326027*^9, 3.5688993831032825`*^9}, {3.5688994370481772`*^9, 3.568899468217032*^9}, { 3.5688995813016305`*^9, 3.5688997165538683`*^9}, {3.5688998495129013`*^9, 3.568899932364647*^9}, {3.568899967667509*^9, 3.568900024529609*^9}, { 3.5689000794261055`*^9, 3.568900136257005*^9}, {3.5689001767858763`*^9, 3.56890020149632*^9}, {3.568902068726*^9, 3.568902074139209*^9}, 3.56890216040736*^9, 3.568902344113283*^9, {3.5689024237982235`*^9, 3.56890243907065*^9}, 3.5689025770684924`*^9, {3.568910195129884*^9, 3.5689102262831383`*^9}, {3.5689126851126575`*^9, 3.5689126875306616`*^9}, {3.5690878255169816`*^9, 3.569087857185037*^9}, { 3.5691452963224173`*^9, 3.569145370484948*^9}, {3.5691454640695124`*^9, 3.5691454653799143`*^9}, {3.5691523784970884`*^9, 3.569152451988817*^9}, { 3.569152629610729*^9, 3.5691526609667845`*^9}, 3.5691527650033674`*^9, { 3.5691528050174375`*^9, 3.5691528220994673`*^9}, {3.5691528694611506`*^9, 3.5691529180864363`*^9}, {3.5691531888249116`*^9, 3.569153192974519*^9}, 3.569153245359411*^9, {3.5691532970111017`*^9, 3.5691533046239147`*^9}, { 3.5691708905147295`*^9, 3.56917090235515*^9}, {3.5691714357512875`*^9, 3.569171449775712*^9}, 3.56917197825784*^9}], Cell[BoxData["82.54010374208545`"], "Output", CellChangeTimes->{3.5710449979934816`*^9, 3.5802161044645357`*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[ RowBox[{"ratio", "=", RowBox[{ RowBox[{"-", RowBox[{"(", RowBox[{"Vne", "+", RowBox[{"2", "*", "Vnn"}]}], ")"}]}], "/", RowBox[{"(", RowBox[{"Vee", "-", "Vnn"}], ")"}]}]}]], "Input", CellChangeTimes->{{3.580216098427325*^9, 3.580216098427325*^9}}], Cell[BoxData["5.988721756003477`"], "Output", CellChangeTimes->{3.5802161044801354`*^9}] }, Open ]], Cell[CellGroupData[{ Cell[BoxData[{"Vee", "\[IndentingNewLine]", "Vnn", "\[IndentingNewLine]", \ "Vne", "\[IndentingNewLine]", RowBox[{"Vtot", "=", RowBox[{ "Vne", "+", "Vee", "+", "Vnn"}]}], "\[IndentingNewLine]", "Ttot", "\[IndentingNewLine]", RowBox[{"Vir", " ", "=", RowBox[{ RowBox[{"-", "Vtot"}], "/", "Ttot"}]}], "\[IndentingNewLine]", RowBox[{"Etot", "=", RowBox[{"Ttot", "+", "Vtot"}]}], "\[IndentingNewLine]"}], "Input", CellChangeTimes->{{3.5689074950860367`*^9, 3.5689075109980645`*^9}, { 3.568910298074465*^9, 3.5689103015064707`*^9}, {3.568910724064413*^9, 3.5689107693044925`*^9}, {3.568955368910859*^9, 3.568955378629676*^9}, { 3.568955601366867*^9, 3.568955616218093*^9}, {3.5704638504275074`*^9, 3.570463876370353*^9}, {3.570464305074706*^9, 3.5704643133895206`*^9}, { 3.570464352171189*^9, 3.570464353231991*^9}, {3.570712404698539*^9, 3.5707124150569572`*^9}, {3.570809962851386*^9, 3.5708101493809137`*^9}, { 3.5708102160710306`*^9, 3.570810245165082*^9}, {3.5708102767551374`*^9, 3.5708103693413*^9}, {3.570810404207361*^9, 3.5708104232081947`*^9}, { 3.5708104788690925`*^9, 3.5708104825818987`*^9}, {3.5708105169643593`*^9, 3.570810517884761*^9}, {3.570810561767638*^9, 3.5708105625476394`*^9}, { 3.5708106179589367`*^9, 3.570810645648985*^9}, {3.5708552812279787`*^9, 3.570855300572013*^9}}], Cell[BoxData["130.1042242781981`"], "Output", CellChangeTimes->{3.5710449980090814`*^9, 3.580216104495735*^9}], Cell[BoxData["82.54010374208545`"], "Output", CellChangeTimes->{3.5710449980090814`*^9, 3.580216104495735*^9}], Cell[BoxData[ RowBox[{"-", "449.9284909439605`"}]], "Output", CellChangeTimes->{3.5710449980090814`*^9, 3.580216104495735*^9}], Cell[BoxData[ RowBox[{"-", "237.28416292367697`"}]], "Output", CellChangeTimes->{3.5710449980090814`*^9, 3.580216104495735*^9}], Cell[BoxData["118.36637044330021`"], "Output", CellChangeTimes->{3.5710449980090814`*^9, 3.580216104495735*^9}], Cell[BoxData["2.004658603917746`"], "Output", CellChangeTimes->{3.5710449980090814`*^9, 3.580216104495735*^9}], Cell[BoxData[ RowBox[{"-", "118.91779248037676`"}]], "Output", CellChangeTimes->{3.5710449980090814`*^9, 3.580216104495735*^9}] }, Open ]] }, WindowSize->{1409, 939}, WindowMargins->{{Automatic, 60}, {Automatic, 15}}, PrintingCopies->1, PrintingPageRange->{32000, 32000}, PrintingOptions->{"Magnification"->1., "PaperOrientation"->"Portrait", "PaperSize"->{595.2, 841.8}}, FrontEndVersion->"9.0 for Microsoft Windows (64-bit) (January 25, 2013)", StyleDefinitions->"Default.nb" ] (* End of Notebook Content *) (* Internal cache information *) (*CellTagsOutline CellTagsIndex->{} *) (*CellTagsIndex CellTagsIndex->{} *) (*NotebookFileOutline Notebook[{ Cell[557, 20, 1480, 27, 52, "Input"], Cell[CellGroupData[{ Cell[2062, 51, 403, 8, 52, "Input"], Cell[2468, 61, 1917, 36, 181, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[4422, 102, 748, 15, 52, "Input"], Cell[5173, 119, 1764, 45, 191, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[6974, 169, 682, 11, 31, "Input"], Cell[7659, 182, 327, 5, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[8023, 192, 955, 14, 31, "Input"], Cell[8981, 208, 94, 1, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[9112, 214, 1560, 29, 31, "Input"], Cell[10675, 245, 327, 5, 31, "Output"] }, Open ]], Cell[11017, 253, 1390, 22, 31, "Input"], Cell[12410, 277, 1566, 28, 31, "Input"], Cell[CellGroupData[{ Cell[14001, 309, 1234, 18, 31, "Input"], Cell[15238, 329, 860, 25, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[16135, 359, 697, 14, 31, "Input"], Cell[16835, 375, 238, 5, 31, "Output"] }, Open ]], Cell[17088, 383, 908, 24, 31, "Input"], Cell[CellGroupData[{ Cell[18021, 411, 5635, 122, 52, "Input"], Cell[23659, 535, 277, 6, 31, "Output"], Cell[23939, 543, 280, 6, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[24256, 554, 519, 12, 31, "Input"], Cell[24778, 568, 327, 5, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[25142, 578, 1401, 38, 31, "Input"], Cell[26546, 618, 260, 5, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[26843, 628, 827, 23, 92, "Input"], Cell[27673, 653, 96, 1, 31, "Output"], Cell[27772, 656, 96, 1, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[27905, 662, 357, 7, 52, "Input"], Cell[28265, 671, 112, 1, 31, "Output"] }, Open ]], Cell[28392, 675, 1824, 35, 72, "Input"], Cell[30219, 712, 935, 19, 31, "Input"], Cell[31157, 733, 4271, 83, 92, "Input"], Cell[35431, 818, 3292, 57, 31, "Input"], Cell[CellGroupData[{ Cell[38748, 879, 348, 7, 52, "Input"], Cell[39099, 888, 7082, 171, 81, "Output"] }, Open ]], Cell[46196, 1062, 2567, 59, 52, "Input"], Cell[48766, 1123, 1254, 35, 72, "Input"], Cell[CellGroupData[{ Cell[50045, 1162, 4783, 85, 72, "Input"], Cell[54831, 1249, 2015, 42, 191, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[56883, 1296, 2506, 53, 112, "Input"], Cell[59392, 1351, 94, 1, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[59523, 1357, 2272, 46, 72, "Input"], Cell[61798, 1405, 151, 3, 31, "Output"] }, Open ]], Cell[61964, 1411, 6123, 156, 152, "Input"], Cell[CellGroupData[{ Cell[68112, 1571, 3596, 80, 112, "Input"], Cell[71711, 1653, 304, 6, 31, "Output"] }, Open ]], Cell[72030, 1662, 2072, 49, 112, "Input"], Cell[74105, 1713, 561, 12, 52, "Input"], Cell[74669, 1727, 2148, 49, 92, "Input"], Cell[76820, 1778, 2452, 56, 92, "Input"], Cell[79275, 1836, 1759, 41, 72, "Input"], Cell[CellGroupData[{ Cell[81059, 1881, 923, 20, 31, "Input"], Cell[81985, 1903, 112, 1, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[82134, 1909, 711, 18, 31, "Input"], Cell[82848, 1929, 112, 1, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[82997, 1935, 507, 10, 31, "Input"], Cell[83507, 1947, 112, 1, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[83656, 1953, 823, 23, 31, "Input"], Cell[84482, 1978, 110, 1, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[84629, 1984, 204, 4, 31, "Input"], Cell[84836, 1990, 110, 1, 31, "Output"] }, Open ]], Cell[84961, 1994, 1971, 35, 92, "Input"], Cell[CellGroupData[{ Cell[86957, 2033, 1770, 24, 31, "Input"], Cell[88730, 2059, 2313, 46, 206, "Output"] }, Open ]], Cell[91058, 2108, 1655, 24, 31, "Input"], Cell[92716, 2134, 3760, 76, 72, "Input"], Cell[96479, 2212, 2696, 53, 92, "Input"], Cell[CellGroupData[{ Cell[99200, 2269, 939, 17, 72, "Input"], Cell[100142, 2288, 993, 24, 52, "Output"], Cell[101138, 2314, 95, 1, 31, "Output"], Cell[101236, 2317, 94, 1, 31, "Output"] }, Open ]], Cell[101345, 2321, 10201, 233, 72, "Input"], Cell[111549, 2556, 6352, 102, 31, "Input"], Cell[117904, 2660, 10215, 234, 72, "Input"], Cell[128122, 2896, 5925, 93, 31, "Input"], Cell[CellGroupData[{ Cell[134072, 2993, 8525, 151, 112, "Input"], Cell[142600, 3146, 5470, 105, 375, "Output"], Cell[148073, 3253, 4090, 72, 375, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[152200, 3330, 3879, 89, 152, "Input"], Cell[156082, 3421, 95, 1, 31, "Output"], Cell[156180, 3424, 2071, 52, 221, "Output"] }, Open ]], Cell[158266, 3479, 3049, 67, 72, "Input"], Cell[161318, 3548, 1841, 29, 52, "Input"], Cell[CellGroupData[{ Cell[163184, 3581, 3517, 75, 112, "Input"], Cell[166704, 3658, 1806, 47, 221, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[168547, 3710, 6437, 145, 132, "Input"], Cell[174987, 3857, 522, 16, 31, "Output"], Cell[175512, 3875, 286, 6, 31, "Output"] }, Open ]], Cell[175813, 3884, 1863, 27, 31, "Input"], Cell[CellGroupData[{ Cell[177701, 3915, 2963, 56, 112, "Input"], Cell[180667, 3973, 110, 1, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[180814, 3979, 2688, 59, 112, "Input"], Cell[183505, 4040, 111, 1, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[183653, 4046, 499, 15, 52, "Input"], Cell[184155, 4063, 129, 2, 31, "Output"] }, Open ]], Cell[184299, 4068, 1381, 21, 31, "Input"], Cell[CellGroupData[{ Cell[185705, 4093, 1709, 32, 52, "Input"], Cell[187417, 4127, 129, 2, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[187583, 4134, 1415, 43, 72, "Input"], Cell[189001, 4179, 130, 2, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[189168, 4186, 2550, 50, 92, "Input"], Cell[191721, 4238, 113, 1, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[191871, 4244, 296, 9, 31, "Input"], Cell[192170, 4255, 89, 1, 31, "Output"] }, Open ]], Cell[CellGroupData[{ Cell[192296, 4261, 1351, 23, 172, "Input"], Cell[193650, 4286, 111, 1, 31, "Output"], Cell[193764, 4289, 111, 1, 31, "Output"], Cell[193878, 4292, 128, 2, 31, "Output"], Cell[194009, 4296, 129, 2, 31, "Output"], Cell[194141, 4300, 112, 1, 31, "Output"], Cell[194256, 4303, 111, 1, 31, "Output"], Cell[194370, 4306, 129, 2, 63, "Output"] }, Open ]] } ] *) (* End of internal cache information *)