core/indigo-core/molecule/monomers_basic

#ifndef __monomers_basic_templates__ #define __monomers_basic_templates__ namespace indigo { const auto kMonomersBasicTemplates = "{\n" " \"root\": {\n" " \"nodes\": [],\n" " \"connections\": [],\n" " \"templates\": [\n" " {\n" " \"$ref\": \"monomerTemplate-P\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-sP\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Rib\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-LR\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-mR\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Ade\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Cyt\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Gua\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Thy\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Ura\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Ino\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-dRib\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Ala\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Asp\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Glu\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Phe\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Gly\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-His\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Ile\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Lys\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Leu\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Met\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Asn\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Pro\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Gln\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Arg\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Ser\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Sec\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Thr\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Val\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Trp\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Tyr\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Cys\"\n" " },\n" " {\n" " \"$ref\": \"monomerTemplate-Pyl\"\n" " }\n" " ]\n" " },\n" " \"monomerTemplate-P\": {\n" " \"type\": \"monomerTemplate\",\n" " \"id\": \"P\",\n" " \"fullName\": \"Phosphate\",\n" " \"class\": \"Phosphate\",\n" " \"classHELM\": \"RNA\",\n" " \"alias\": \"P\",\n" " \"naturalAnalog\": \"P\",\n" " \"naturalAnalogShort\": \"P\",\n" " \"attachmentPoints\": [\n" " {\n" " \"attachmentAtom\": 0,\n" " \"leavingGroup\": {\n" " \"atoms\": [\n" " 1\n" " ]\n" " }\n" " },\n" " {\n" " \"attachmentAtom\": 0,\n" " \"leavingGroup\": {\n" " \"atoms\": [\n" " 3\n" " ]\n" " }\n" " }\n" " ],\n" " \"atoms\": [\n" " {\n" " \"label\": \"P\",\n" " \"location\": [\n" " -0.19991692871090108,\n" " 0,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " -1.1999182394782262,\n" " 0,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " 0.29983372634506966,\n" " -0.8661678020096315,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " 0.800084382056424,\n" " 0,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " 0.29983372634506966,\n" " 0.8661678020096315,\n" " 0\n" " ]\n" " }\n" " ],\n" " \"bonds\": [\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 0,\n" " 1\n" " ]\n" " },\n" " {\n" " \"type\": 2,\n" " \"atoms\": [\n" " 0,\n" " 2\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 0,\n" " 3\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 0,\n" " 4\n" " ]\n" " }\n" " ]\n" " },\n" " \"monomerTemplate-sP\": {\n" " \"type\": \"monomerTemplate\",\n" " \"id\": \"sP\",\n" " \"fullName\": \"Phosphate\",\n" " \"class\": \"Phosphate\",\n" " \"classHELM\": \"RNA\",\n" " \"alias\": \"sP\",\n" " \"naturalAnalog\": \"P\",\n" " \"naturalAnalogShort\": \"P\",\n" " \"attachmentPoints\": [\n" " {\n" " \"attachmentAtom\": 0,\n" " \"leavingGroup\": {\n" " \"atoms\": [\n" " 1\n" " ]\n" " },\n" " \"type\": \"left\"\n" " },\n" " {\n" " \"attachmentAtom\": 0,\n" " \"leavingGroup\": {\n" " \"atoms\": [\n" " 3\n" " ]\n" " },\n" " \"type\": \"right\"\n" " }\n" " ],\n" " \"atoms\": [\n" " {\n" " \"label\": \"P\",\n" " \"location\": [\n" " -0.19991692871090108,\n" " 0,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " -1.1999182394782262,\n" " 0,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " 0.29983372634506966,\n" " -0.8661678020096315,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " 0.800084382056424,\n" " 0,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"S\",\n" " \"location\": [\n" " 0.29983372634506966,\n" " 0.8661678020096315,\n" " 0\n" " ]\n" " }\n" " ],\n" " \"bonds\": [\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 0,\n" " 1\n" " ]\n" " },\n" " {\n" " \"type\": 2,\n" " \"atoms\": [\n" " 0,\n" " 2\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 0,\n" " 3\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 0,\n" " 4\n" " ]\n" " }\n" " ]\n" " }," " \"monomerTemplate-Rib\": {\n" " \"type\": \"monomerTemplate\",\n" " \"id\": \"Rib\",\n" " \"fullName\": \"Ribose\",\n" " \"class\": \"Sugar\",\n" " \"classHELM\": \"RNA\",\n" " \"alias\": \"R\",\n" " \"naturalAnalog\": \"Rib\",\n" " \"naturalAnalogShort\": \"R\",\n" " \"attachmentPoints\": [\n" " {\n" " \"attachmentAtom\": 9,\n" " \"leavingGroup\": {\n" " \"atoms\": [\n" " 10\n" " ]\n" " }\n" " },\n" " {\n" " \"attachmentAtom\": 5,\n" " \"leavingGroup\": {\n" " \"atoms\": [\n" " 11\n" " ]\n" " }\n" " },\n" " {\n" " \"attachmentAtom\": 2,\n" " \"leavingGroup\": {\n" " \"atoms\": [\n" " 8\n" " ]\n" " }\n" " }\n" " ],\n" " \"atoms\": [\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " -0.7870668737745955,\n" " -0.7617767155358548,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " -0.4212883139374412,\n" " 0.2454717053907153,\n" " 0\n" " ],\n" " \"stereoLabel\": \"abs\"\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " 0.05779587009926911,\n" " -1.4208925344924144,\n" " 0\n" " ],\n" " \"stereoLabel\": \"abs\"\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " 0.6497570315857263,\n" " 0.20889384940699984,\n" " 0\n" " ],\n" " \"stereoLabel\": \"abs\"\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " 0.9458090534539231,\n" " -0.821072849259456,\n" " 0\n" " ],\n" " \"stereoLabel\": \"abs\"\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " 1.306300970043431,\n" " 1.0541137989057054,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " 1.7515935019701854,\n" " -1.1136956971291794,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " -1.022322498294859,\n" " 1.131198772746387,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " 0.028505008862309486,\n" " -2.2776145051109995,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " -2.091724697943758,\n" " 1.0541137989057054,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"H\",\n" " \"location\": [\n" " -2.573094997979451,\n" " 1.7634527287149055,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"H\",\n" " \"location\": [\n" " 2.1556645047902916,\n" " 0.9376647652075489,\n" " 0\n" " ]\n" " }\n" " ],\n" " \"bonds\": [\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 0,\n" " 1\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 0,\n" " 2\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 1,\n" " 3\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 1,\n" " 7\n" " ],\n" " \"stereo\": 6\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 2,\n" " 4\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 2,\n" " 8\n" " ],\n" " \"stereo\": 6\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 3,\n" " 4\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 3,\n" " 5\n" " ],\n" " \"stereo\": 1\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 4,\n" " 6\n" " ],\n" " \"stereo\": 1\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 5,\n" " 11\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 7,\n" " 9\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 9,\n" " 10\n" " ]\n" " }\n" " ]\n" " },\n" " \"monomerTemplate-LR\": {\n" " \"type\": \"monomerTemplate\",\n" " \"id\": \"LR\",\n" " \"fullName\": \"2,'4'-locked-Ribose\",\n" " \"class\": \"Sugar\",\n" " \"classHELM\": \"RNA\",\n" " \"alias\": \"LR\",\n" " \"naturalAnalog\": \"Rib\",\n" " \"naturalAnalogShort\": \"R\",\n" " \"attachmentPoints\": [\n" " {\n" " \"attachmentAtom\": 8,\n" " \"leavingGroup\": {\n" " \"atoms\": [\n" " 9\n" " ]\n" " },\n" " \"type\": \"left\"\n" " },\n" " {\n" " \"attachmentAtom\": 5,\n" " \"leavingGroup\": {\n" " \"atoms\": [\n" " 10\n" " ]\n" " },\n" " \"type\": \"right\"\n" " },\n" " {\n" " \"attachmentAtom\": 2,\n" " \"leavingGroup\": {\n" " \"atoms\": [\n" " 7\n" " ]\n" " },\n" " \"type\": \"side\"\n" " }\n" " ],\n" " \"atoms\": [\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " -0.6408069550632618,\n" " 0.025362798468799477,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " 0.3575229898739885,\n" " -0.36716613720847996,\n" " 0\n" " ],\n" " \"stereoLabel\": \"abs\"\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " -1.0304957857036705,\n" " -0.7046762939156813,\n" " 0\n" " ],\n" " \"stereoLabel\": \"abs\"\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " 1.270517685796424,\n" " 0.04795154085507401,\n" " 0\n" " ],\n" " \"stereoLabel\": \"abs\"\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " -0.13625899281545137,\n" " -1.1351833783418142,\n" " 0\n" " ],\n" " \"stereoLabel\": \"abs\"\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " 1.0314204710645123,\n" " 1.0201260998713748,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " 0.24728728507079492,\n" " 0.6217188072573164,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " -1.7668755777053513,\n" " -0.41155103452887903,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " -0.660423494503974,\n" " 1.0201260998713748,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"H\",\n" " \"location\": [\n" " -0.7478723100578556,\n" " 1.807891978354113,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"H\",\n" " \"location\": [\n" " 1.6107358496318043,\n" " 1.5609349380550472,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " 0.41247571988972076,\n" " -1.331018527977206,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " 0.052707065567973915,\n" " -2.154648988669731,\n" " 0\n" " ]\n" " }\n" " ],\n" " \"bonds\": [\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 0,\n" " 1\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 0,\n" " 2\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 1,\n" " 3\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 1,\n" " 6\n" " ],\n" " \"stereo\": 1\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 2,\n" " 4\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 2,\n" " 7\n" " ],\n" " \"stereo\": 6\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 3,\n" " 4\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 5,\n" " 10\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 6,\n" " 8\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 8,\n" " 9\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 1,\n" " 11\n" " ],\n" " \"stereo\": 6\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 11,\n" " 12\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 4,\n" " 12\n" " ],\n" " \"stereo\": 1\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 3,\n" " 5\n" " ],\n" " \"stereo\": 1\n" " }\n" " ]\n" " },\n" " \"monomerTemplate-mR\": {\n" " \"type\": \"monomerTemplate\",\n" " \"id\": \"mR\",\n" " \"fullName\": \"2'-O-Methyl-Ribose\",\n" " \"class\": \"Sugar\",\n" " \"classHELM\": \"RNA\",\n" " \"alias\": \"mR\",\n" " \"naturalAnalog\": \"Rib\",\n" " \"naturalAnalogShort\": \"R\",\n" " \"attachmentPoints\": [\n" " {\n" " \"attachmentAtom\": 9,\n" " \"leavingGroup\": {\n" " \"atoms\": [\n" " 10\n" " ]\n" " },\n" " \"type\": \"left\"\n" " },\n" " {\n" " \"attachmentAtom\": 5,\n" " \"leavingGroup\": {\n" " \"atoms\": [\n" " 11\n" " ]\n" " },\n" " \"type\": \"right\"\n" " },\n" " {\n" " \"attachmentAtom\": 2,\n" " \"leavingGroup\": {\n" " \"atoms\": [\n" " 8\n" " ]\n" " },\n" " \"type\": \"side\"\n" " }\n" " ],\n" " \"atoms\": [\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " -1.3493,\n" " -0.8393,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " -0.8372,\n" " 0.5706,\n" " 0\n" " ],\n" " \"stereoLabel\": \"abs\"\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " -0.1666,\n" " -1.762,\n" " 0\n" " ],\n" " \"stereoLabel\": \"abs\"\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " 0.6619,\n" " 0.5193,\n" " 0\n" " ],\n" " \"stereoLabel\": \"abs\"\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " 1.0764,\n" " -0.9223,\n" " 0\n" " ],\n" " \"stereoLabel\": \"abs\"\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " 1.5811,\n" " 1.7025,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " 2.4836,\n" " -1.4367,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " -1.6785,\n" " 1.8103,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " -0.2077,\n" " -2.9612,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " -3.1754,\n" " 1.7025,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"H\",\n" " \"location\": [\n" " -3.8492,\n" " 2.6954,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"H\",\n" " \"location\": [\n" " 2.7699,\n" " 1.5395,\n" " 0\n" " ]\n" " },\n" " 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\"location\": [\n" " -0.00203165790085422,\n" " -3.2675831238738704,\n" " 0\n" " ],\n" " \"stereoLabel\": \"abs\"\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " 0.8641318271633283,\n" " -3.767709577134151,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " 1.7302106598149751,\n" " -3.2675831238738704,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " 0.8641318271633283,\n" " -4.767793178829641,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " -0.00203165790085422,\n" " -2.2674995221783805,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " 0.4980101429468907,\n" " -1.4013360371141983,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " -0.00203165790085422,\n" " -0.5351725520500158,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " 0.4980101429468907,\n" " 0.33090628060163113,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"N\",\n" " \"location\": [\n" " -0.00203165790085422,\n" " 1.1970697656658136,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " 0.4980101429468907,\n" " 2.063233250729996,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " -0.00203165790085422,\n" " 2.929312083381643,\n" " 0\n" " ],\n" " \"stereoLabel\": \"abs\"\n" " },\n" " {\n" " \"label\": \"O\",\n" " \"location\": [\n" " 1.498178397054916,\n" " 2.063233250729996,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " -0.9961895907188526,\n" " 3.0338578128630997,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " -1.204011263493732,\n" " 4.011677830061728,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"C\",\n" " \"location\": [\n" " -0.33835569290476325,\n" " 4.511465673671867,\n" " 0\n" " ]\n" " },\n" " {\n" " \"label\": \"N\",\n" " \"location\": [\n" " 0.4045538795075966,\n" " 3.842542309815615,\n" " 0\n" " 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\"type\": 1,\n" " \"atoms\": [\n" " 11,\n" " 12\n" " ]\n" " },\n" " {\n" " \"type\": 2,\n" " \"atoms\": [\n" " 11,\n" " 13\n" " ]\n" " },\n" " {\n" " \"type\": 2,\n" " \"atoms\": [\n" " 16,\n" " 17\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 15,\n" " 16\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 14,\n" " 15\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 12,\n" " 14\n" " ],\n" " \"stereo\": 1\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 17,\n" " 12\n" " ]\n" " },\n" " {\n" " \"type\": 1,\n" " \"atoms\": [\n" " 14,\n" " 18\n" " ]\n" " }\n" " ]\n" " }" "}"; } #endif

core/indigo-core/molecule/monomers_basic_templates.h (6,803 lines of code) (raw):