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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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133461 51530840 1 N2O5H24C25 A2B5C24D25 -131.96 8.81 -8.34 -0.58 1
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133462 51530841 1 OF3N5H25C27 AB3C5D25E27 -94.62 1.67 0.0 0.0 -1
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133463 51530842 1 F3N4O4H20C21 A3B4C4D20E21 -184.94 2.41 0.0 0.0 0
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133464 51530974 1 SN3O4C17H21 AB3C4D17E21 -38.48 8.04 -8.21 -1.71 0
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133465 51530975 1 SN2O3C19H24 AB2C3D19E24 -87.22 3.2 -8.11 -1.03 0
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133466 51530976 1 ClSO2N3C16H20 ABC2D3E16F20 -39.27 4.61 -8.3 -1.24 0
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133467 51530977 1 SO2N3C18H21 AB2C3D18E21 -8.21 4.65 -8.24 -1.23 0
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133468 51530978 1 SN2O4C20H26 AB2C4D20E26 -121.64 8.79 -7.96 -0.71 -1
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133469 51531215 1 SO3N4C17H17 AB3C4D17E17 5.5 4.49 0.0 0.0 0
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133470 51531220 1 OSN3H17C19 ABC3D17E19 68.84 14.15 -7.61 -1.33 1
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133471 51531566 1 NC12H18 AB12C18 28.32 4.11 0.0 0.0 0
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133472 51531877 1 O2F3N8H15C20 A2B3C8D15E20 -20.88 11.51 -9.28 -1.75 0
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133473 51532188 1 N3O3C22H27 A3B3C22D27 -113.0 5.32 -8.73 0.12 0
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133474 51532189 1 N3O3C22H27 A3B3C22D27 -112.45 4.08 -8.71 0.14 0
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133475 51532208 2 NOC9H9 ABC9D9 -56.99 2.94 -8.72 -0.47 0
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133476 51532239 1 N2F3O3H17C19 A2B3C3D17E19 -235.53 6.5 -9.18 -0.59 0
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133477 51532240 1 N2F3O3H17C19 A2B3C3D17E19 -236.06 6.88 -9.21 -0.58 0
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133478 51533146 1 IN2O3C17H19 AB2C3D17E19 -107.21 4.39 -9.04 -1.03 1
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133479 51533550 1 SN3O3C21H28 AB3C3D21E28 -54.96 17.12 0.0 0.0 1
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133480 51533615 1 FSO3N5C22H27 ABC3D5E22F27 -108.54 8.48 0.0 0.0 0
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133481 51533861 1 SN2O2H22C23 AB2C2D22E23 -18.34 4.52 -8.96 -0.68 0
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133482 51533862 1 SN2O2H22C23 AB2C2D22E23 -17.75 6.82 -8.95 -0.62 0
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133483 51534035 1 NOC5H7 ABC5D7 -22.63 2.69 -10.68 0.02 0
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133484 51534175 1 O3N5C25H39 A3B5C25D39 -167.39 6.06 -9.01 -0.45 0
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133485 51534231 1 N3O3C21H29 A3B3C21D29 -55.5 3.97 -8.92 -0.64 0