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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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191224 78119955 1 SO2N6H14C17 AB2C6D14E17 153.25 6.11 -8.6 -1.62 0
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191225 78120092 1 NO5C43H63 AB5C43D63 -263.63 2.76 -8.98 0.06 0
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191226 78120220 1 FNCl2O3H14C15 ABC2D3E14F15 -137.74 1.42 -8.8 -0.96 -4
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191227 78120409 1 SP3N7O18C45H68 AB3C7D18E45F68 -761.31 6.14 -9.35 -2.18 0
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191228 78120410 1 PN7O67C121H214 AB7C67D121E214 -3227.57 17.44 -9.59 -1.84 0
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191229 78120479 1 SP3N7O18C43H70 AB3C7D18E43F70 -956.81 1.66 -9.4 -0.88 0
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191230 78120924 1 OCl2N6C25H26 AB2C6D25E26 52.03 8.09 -8.59 -0.98 0
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191231 78121146 1 O4N6C23H26 A4B6C23D26 -61.35 4.88 -8.45 -0.34 0
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191232 78121275 1 ClON6C25H25 ABC6D25E25 80.44 5.26 -8.79 -1.1 0
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191233 78121581 1 N2S2O8H24C27 A2B2C8D24E27 -217.64 7.76 -8.5 -1.57 0
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191234 78121582 1 SN2O8H28C33 AB2C8D28E33 -207.23 7.5 -8.51 -1.26 0
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191235 78121686 1 NO4C17H23 AB4C17D23 -170.4 4.15 -9.56 0.02 0
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191236 78122008 1 ON5C24H27 AB5C24D27 65.8 4.67 -8.77 -0.17 0
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191237 78122009 1 Cl2O3N5C28H29 A2B3C5D28E29 -65.25 9.58 -9.15 -0.54 0
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191238 78122010 2 O5N7C19H31 A5B7C19D31 -434.54 11.95 -8.71 -0.25 0
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191239 78122011 1 SO9N16C30H58 AB9C16D30E58 -395.94 6.92 -9.19 -0.3 0
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191240 78122269 1 N3O4C19H33 A3B4C19D33 -196.53 6.31 -8.84 0.2 0
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191241 78122270 1 NO5C23H31 AB5C23D31 -200.78 3.69 -8.75 -1.04 0
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191243 78122272 1 O12N15C48H83 A12B15C48D83 -455.85 12.96 -8.93 -1.45 0
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191244 78122381 1 O3N4C28H34 A3B4C28D34 -56.9 6.96 -8.06 -0.82 0
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191245 78123185 1 SN3O3C21H23 AB3C3D21E23 -46.99 8.21 -8.98 -0.47 0
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191246 78123186 1 SN3O3C21H23 AB3C3D21E23 -48.56 7.04 -8.97 -0.41 0
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191247 78123187 1 BrOSN2H19C20 ABCD2E19F20 50.89 4.67 -9.12 -0.33 0
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191248 78123205 1 SO3N4C21H22 AB3C4D21E22 23.04 2.87 -9.64 -1.56 0
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191249 78123206 1 OSF3N3C17H20 ABC3D3E17F20 -164.49 6.63 -9.61 -0.94 0
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191250 78123500 1 N3O5C34H35 A3B5C34D35 -119.88 11.23 -8.58 -0.82 0
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191251 78123501 1 O8N21C48H95 A8B21C48D95 -417.67 4.88 -9.06 0.0 0
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191252 78123845 2 N17O20C50H83 A17B20C50D83 -1817.17 36.85 -8.97 -2.03 0
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191253 78123935 1 ClN2O4C28H35 AB2C4D28E35 -167.23 7.76 -9.58 -0.91 0
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191254 78123936 1 Cl2N8O19H68C73 A2B8C19D68E73 -454.63 9.6 -8.22 -1.7 0
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191255 78123937 1 NOC24H35 ABC24D35 -49.74 7.57 -8.59 -0.29 0
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191256 78123938 1 Cl2N9O19H69C73 A2B9C19D69E73 -570.61 7.31 -8.98 -1.2 0
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191257 78123939 1 Cl2N8O19H64C72 A2B8C19D64E72 -291.53 25.13 -6.25 -3.1 0
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191258 78123940 1 SN18O21C82H134 AB18C21D82E134 -1007.21 6.43 -8.37 -0.88 0
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191259 78123941 1 SN18O19C80H132 AB18C19D80E132 -919.88 14.6 -8.24 0.02 0
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191260 78123942 1 ClFN2O4C28H36 ABC2D4E28F36 -242.89 8.61 -9.66 -0.9 0
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191261 78123943 1 N3O4C37H39 A3B4C37D39 -98.27 10.45 -8.49 -1.08 0
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191262 78123944 2 ClN2O2H10C12 AB2C2D10E12 11.94 5.42 -9.88 -1.57 2
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191264 78123946 1 N7H13C16 A7B13C16 208.98 9.43 -8.98 -1.35 2
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191265 78123947 1 FeN6H22C23 AB6C22D23 228.36 5.2 -7.24 -0.86 0
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191266 78123948 2 N3H8C9 A3B8C9 187.31 5.22 -8.9 -1.14 2
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191268 78123950 1 Cl2N3H15C17 A2B3C15D17 88.09 4.05 -8.87 -0.96 0
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191269 78123951 1 Cl2N9O17H59C68 A2B9C17D59E68 -254.07 20.01 -7.88 -2.02 0
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191270 78123955 1 N4O10C23H28 A4B10C23D28 -363.17 8.08 -9.32 -0.47 0
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191271 78124051 1 PO4N5C21H26 AB4C5D21E26 -127.91 5.7 -9.03 -0.46 0
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191272 78124052 1 PO4N5C17H18 AB4C5D17E18 -115.49 4.04 -9.12 -0.56 0
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191273 78124134 1 O33N36C111H190 A33B36C111D190 -1629.18 19.2 -7.77 -0.6 0
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191274 78124135 1 O33N36C112H192 A33B36C112D192 -1665.69 19.24 -8.91 -0.24 0
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191275 78124136 2 N16O16C57H97 A16B16C57D97 -1611.08 27.57 -8.29 -1.08 0
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191276 78124137 1 O33N35C112H191 A33B35C112D191 -1692.44 11.99 -9.76 -0.62 0