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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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188634 77746194 2 NO2C11H11 AB2C11D11 -89.07 9.14 -9.14 -0.62 0
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188635 77746195 1 N3O3C23H29 A3B3C23D29 -43.38 1.95 -9.29 -0.82 0
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188636 77746196 1 O4C13H22 A4B13C22 -194.24 2.18 -10.22 -0.07 0
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188637 77746379 1 F3O4N7C34H38 A3B4C7D34E38 -152.16 12.74 -9.17 -0.9 0
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188638 77746716 1 N7O10C26H51 A7B10C26D51 -464.6 2.96 -9.15 0.5 0
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188639 77746717 1 F3N5O7C34H38 A3B5C7D34E38 -384.96 7.14 -9.17 -0.96 0
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188640 77746976 1 N3O3C20H25 A3B3C20D25 -24.2 6.84 -9.04 -1.27 0
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188641 77747363 1 FON3C12H12 ABC3D12E12 41.59 1.36 -8.52 -0.1 0
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188642 77747420 1 Cl2O3N5C29H31 A2B3C5D29E31 -64.23 6.29 -8.0 -0.52 0
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188643 77747476 1 ClN3O5C26H36 AB3C5D26E36 -206.91 7.32 -9.08 -0.5 0
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188644 77747477 1 N5O6C17H31 A5B6C17D31 -298.8 4.61 -9.07 0.24 0
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188645 77747478 1 ClO3N8C25H31 AB3C8D25E31 -62.32 5.3 -8.09 -0.64 0
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188646 77747479 1 NO5C18H25 AB5C18D25 -224.61 1.62 -9.04 0.0 0
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188647 77747480 1 O3N6C28H38 A3B6C28D38 -38.67 4.19 -8.48 -0.82 0
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188648 77747481 1 FIOC11H12 ABCD11E12 -74.6 3.04 -9.26 -1.13 0
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188649 77747771 1 N5O6C19H21 A5B6C19D21 -158.22 4.85 -9.49 -2.02 0
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188650 77748142 1 SiO3C24H30 AB3C24D30 -128.08 2.59 -8.98 0.08 0
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188651 77748502 1 ClON7C9H22 ABC7D9E22 -53.24 4.55 -8.92 0.18 0
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188652 77748503 1 ON4H20C21 AB4C20D21 71.56 2.06 -8.78 -0.64 0
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188653 77748504 1 Cl2S2N4O5C28H32 A2B2C4D5E28F32 -135.42 13.04 -8.82 -1.4 0
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188654 77748542 2 FNO4H10C11 ABC4D10E11 -297.24 11.66 -10.28 -1.44 0
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188655 77748543 1 ON2C17H18 AB2C17D18 17.54 1.85 -8.98 -0.02 1
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188656 77748931 1 O3N4C21H21 A3B4C21D21 -24.31 4.38 0.0 0.0 0
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188657 77749259 1 ON2C12H24 AB2C12D24 -84.13 5.11 -9.3 1.31 1
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188658 77749261 1 BrO2N4H18C20 AB2C4D18E20 18.85 4.59 0.0 0.0 1