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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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219993 85165122 2 NO4C18H21 AB4C18D21 -286.22 9.54 -8.76 -0.21 0
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219994 85165123 1 N2O7C36H56 A2B7C36D56 -375.62 13.33 -9.76 0.35 0
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219995 85165124 1 SiN2O4C37H64 AB2C4D37E64 -270.3 2.46 -8.21 -0.85 1
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219996 85165125 1 SiN2O4C37H65 AB2C4D37E65 -259.57 5.11 0.0 0.0 0
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219997 85165126 1 O7N9C30H31 A7B9C30D31 -167.0 8.28 -9.02 -1.03 0
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219998 85165128 1 S2N5O11C23H43 A2B5C11D23E43 -527.04 7.8 -9.36 -0.15 0
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219999 85165129 1 NO5C39H67 AB5C39D67 -345.27 1.06 -9.33 0.24 0
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220000 85165130 1 O14C31H34 A14B31C34 -553.96 2.32 -9.96 -0.67 0
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220001 85165131 1 O9H30C38 A9B30C38 -250.72 6.93 -9.26 -2.11 0
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220002 85165132 3 O4C11H14 A4B11C14 -429.0 9.86 -9.23 -3.27 0
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220003 85165133 1 N4O6H34C37 A4B6C34D37 -150.59 5.45 -8.57 -0.47 0
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220004 85165134 1 FO4N8C33H39 AB4C8D33E39 -135.66 5.57 -8.66 -0.56 0
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220005 85165135 1 S2N6O7C28H34 A2B6C7D28E34 -256.58 8.22 -8.77 -1.68 0
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220006 85165136 1 FN2O6C37H43 AB2C6D37E43 -279.29 2.83 -8.43 -0.18 0
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220007 85165137 1 SN6O7C30H42 AB6C7D30E42 -277.09 6.72 -8.39 -0.26 0
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220008 85165138 1 SO4C40H54 AB4C40D54 -181.35 6.27 -9.75 -0.43 0
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220009 85165139 1 NPO8C35H38 ABC8D35E38 -264.88 5.18 -9.32 -0.09 0
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220010 85165140 1 SN3O8C33H33 AB3C8D33E33 -230.29 4.04 -8.37 -0.82 0
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220011 85165141 1 N3O7C36H45 A3B7C36D45 -276.13 6.42 -9.2 -0.41 0
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220012 85165142 1 ClSN3O7C31H38 ABC3D7E31F38 -184.1 7.91 -9.22 -0.51 0
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220013 85165143 1 FPN6O10C26H26 ABC6D10E26F26 -271.39 12.95 -10.37 -1.61 0
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220014 85165144 1 N2F3O7C33H39 A2B3C7D33E39 -395.86 4.91 -8.86 -1.14 0
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220015 85165145 2 O5C18H20 A5B18C20 -332.06 2.42 -9.43 -0.05 0
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220016 85165147 2 SN3O3H14C15 AB3C3D14E15 -16.09 3.5 -9.39 -1.08 0
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220017 85165148 1 O10C35H52 A10B35C52 -442.33 4.33 -9.17 1.09 0
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220019 85165151 1 PCl2N2O5C32H39 AB2C2D5E32F39 -245.37 4.8 -9.58 -0.49 0
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220020 85165152 1 NO7C39H39 AB7C39D39 -190.3 3.58 -9.06 -0.59 -1
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220021 85165153 1 ClNiO3S3N8H19C22 ABC3D3E8F19G22 114.34 6.94 -8.74 -2.06 0
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220022 85165154 2 SnC14H30 AB14C30 -69.61 0.17 -8.35 0.94 0
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220023 85165155 1 Cl2O4N5C33H33 A2B4C5D33E33 -123.3 7.5 -8.46 -0.22 0
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220024 85165156 1 N2O7C38H38 A2B7C38D38 -167.55 4.42 -8.54 -0.17 0
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220025 85165158 1 N2S2O7C33H34 A2B2C7D33E34 -124.5 6.24 -8.2 -0.7 1
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220026 85165159 1 SN2O4C27H29 AB2C4D27E29 -32.9 7.43 0.0 0.0 0
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220027 85165160 1 S2N6O7C28H38 A2B6C7D28E38 -257.65 7.36 -9.22 -1.02 0
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220028 85165161 1 SN2O5C37H50 AB2C5D37E50 -207.36 8.79 -9.5 -0.31 0
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220029 85165162 1 NO16C27H41 AB16C27D41 -681.45 1.28 -8.53 0.03 0
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220030 85165164 1 SnSi2O3C29H64 AB2C3D29E64 -279.15 3.73 -8.6 0.52 0
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220031 85165165 1 Si2N5O7C29H49 A2B5C7D29E49 -370.89 7.44 -8.85 -1.21 0
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220033 85165167 1 O17C27H40 A17B27C40 -745.07 3.34 -9.76 -0.7 0
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220034 85165168 2 N3O6C13H24 A3B6C13D24 -573.82 7.39 -9.47 0.56 0
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220035 85165169 1 O8N10C27H44 A8B10C27D44 -177.68 10.47 -9.62 -1.04 0
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220036 85165171 1 O4N6C37H44 A4B6C37D44 -103.34 2.52 -8.98 -0.57 0
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220037 85165172 1 N2Si2O3C37H60 A2B2C3D37E60 -222.57 2.06 -8.75 0.17 0
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220038 85165173 1 N3O7C37H39 A3B7C37D39 -234.19 3.44 -8.85 -0.28 0
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220039 85165174 1 O7N8H30C32 A7B8C30D32 -81.19 7.91 -8.98 -0.78 0
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220040 85165176 2 N2O2C19H31 A2B2C19D31 -197.56 3.66 -9.0 -0.23 0
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220041 85165177 1 HgSSiO3C25H31 ABCD3E25F31 -115.25 1.71 0.0 0.0 0
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220042 85165178 1 SeSiN2O6C30H48 ABC2D6E30F48 -348.7 3.15 -8.02 0.06 0
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220044 85165180 1 NO3H37C45 AB3C37D45 49.93 2.25 -8.8 -0.44 0
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220045 85165181 1 NO3H37C45 AB3C37D45 54.17 1.96 -8.87 -0.49 0