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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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137637 52237641 1 NO2C15H27 AB2C15D27 -127.14 2.65 -9.27 0.92 0
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137638 52237645 1 N2F3O3C20H21 A2B3C3D20E21 -251.68 4.13 -9.39 -1.36 0
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137639 52237813 1 SO3N5C15H19 AB3C5D15E19 -24.94 7.99 -9.58 -1.83 1
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137640 52238256 1 N3O4C20H24 A3B4C20D24 -97.2 5.39 0.0 0.0 1
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137641 52238257 1 ClN3O3C20H25 AB3C3D20E25 -81.86 4.5 0.0 0.0 0
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137642 52238701 1 NSO3C19H19 ABC3D19E19 -60.2 3.6 -8.87 -0.86 0
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137643 52238755 1 ClN2O2H19C23 AB2C2D19E23 -26.31 7.32 -9.0 -0.33 0
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137644 52239270 1 IOSN2H9C16 ABCD2E9F16 96.21 6.11 -9.54 -1.3 0
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137645 52239803 1 N2O5C22H32 A2B5C22D32 -216.02 5.58 -9.01 -0.35 0
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137646 52239990 1 ON7C22H23 AB7C22D23 95.28 9.67 -9.0 -1.08 0
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137647 52240176 1 O2N3C19H23 A2B3C19D23 -25.07 2.9 -8.53 0.13 0
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137648 52240177 1 O2N3C19H23 A2B3C19D23 -25.44 0.75 -8.72 -0.01 0
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137649 52240178 1 ON3C19H25 AB3C19D25 -0.86 3.79 -8.58 -0.04 0
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137650 52240242 1 N2O2C17H20 A2B2C17D20 -46.46 5.02 -8.76 -0.34 1
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137651 52240590 1 OSN3C18H24 ABC3D18E24 14.45 1.41 0.0 0.0 0
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137652 52241058 1 SO2N6C24H26 AB2C6D24E26 36.32 4.04 -8.38 -0.96 0
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137653 52241072 1 N2O6C23H26 A2B6C23D26 -213.78 4.54 -9.14 -0.98 0
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137654 52241073 1 SO2N6C16H22 AB2C6D16E22 -19.62 3.3 -9.33 -1.09 1
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137655 52241316 1 O2N3C19H30 A2B3C19D30 -80.61 5.29 0.0 0.0 1
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137656 52241998 1 OF3N5C22H31 AB3C5D22E31 -136.7 5.66 0.0 0.0 0
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137657 52242030 1 ClSO2N3H20C22 ABC2D3E20F22 0.18 3.43 -9.13 -0.58 0
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137658 52242142 1 ClN3O3H16C18 AB3C3D16E18 -29.02 4.79 -9.74 -1.36 1
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137659 52242281 1 FN3O3C20H25 AB3C3D20E25 -92.58 0.33 0.0 0.0 0
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137660 52242282 1 FN3O3C20H24 AB3C3D20E24 -106.53 2.69 -9.14 -0.54 1
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137661 52242311 1 ClN3O3C20H25 AB3C3D20E25 -55.43 5.49 0.0 0.0 0