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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