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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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133311 51507193 1 BrNSO5H16C19 ABCD5E16F19 -147.14 3.04 -8.82 -0.88 0
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133312 51507338 1 NSO4C23H27 ABC4D23E27 -173.75 3.6 -8.91 -0.72 0
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133313 51507339 1 NSO4C23H27 ABC4D23E27 -173.97 5.61 -9.02 -0.82 -1
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133314 51508084 1 FSO2N6H16C23 ABC2D6E16F23 35.63 4.09 0.0 0.0 1
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133315 51508085 1 OSN4C24H27 ABC4D24E27 55.62 4.65 0.0 0.0 0
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133316 51508086 1 OSN4C24H26 ABC4D24E26 32.82 4.3 -8.6 -1.01 1
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133317 51508087 1 OSN6C25H27 ABC6D25E27 105.98 1.25 0.0 0.0 0
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133318 51508088 1 OSN6C25H26 ABC6D25E26 82.43 4.75 -8.35 -1.17 1
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133319 51508089 1 OSN5C24H26 ABC5D24E26 95.7 17.04 0.0 0.0 0
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133320 51508129 1 O2F3N4H21C24 A2B3C4D21E24 -123.03 6.29 -9.01 -0.7 -1
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133321 51508642 1 NO4H12C18 AB4C12D18 -56.32 4.14 0.0 0.0 1
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133322 51508661 1 ClON6C23H24 ABC6D23E24 139.24 15.84 0.0 0.0 1
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133323 51508662 1 O2N5C24H30 A2B5C24D30 9.24 6.77 0.0 0.0 0
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133324 51508905 1 FSN3O4H22C25 ABC3D4E22F25 -125.82 2.8 -8.79 -0.51 0
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133325 51508906 1 FN3O4C27H30 AB3C4D27E30 -170.85 7.25 -8.51 -0.45 0
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133326 51508907 1 FN3O4C27H30 AB3C4D27E30 -177.73 5.96 -8.45 -0.35 0
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133327 51508908 1 FN3O4H26C28 AB3C4D26E28 -130.14 6.81 -8.38 -0.42 -1
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133328 51509028 1 FSN2O4C19H20 ABC2D4E19F20 -112.3 15.0 0.0 0.0 -1
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133329 51509285 1 S2O3N6H19C21 A2B3C6D19E21 30.36 8.98 0.0 0.0 0
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133330 51509718 1 N3O5H19C24 A3B5C19D24 -108.69 0.97 -8.75 -0.72 0
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133331 51510630 1 ClSO3N4C25H37 ABC3D4E25F37 -126.86 4.95 -8.87 -0.72 -1
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133332 51510631 1 OS2N7C18H18 AB2C7D18E18 145.27 4.16 0.0 0.0 -1
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133333 51510632 1 SO2N7C19H20 AB2C7D19E20 108.11 11.24 0.0 0.0 -1
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133334 51510633 1 OS2N7C20H20 AB2C7D20E20 181.24 8.56 0.0 0.0 0
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133335 51510634 1 FSO2N4H19C22 ABC2D4E19F22 -4.86 5.16 -9.02 -1.0 0