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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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408786 135081554 1 FKH6C7 ABC6D7 -29.8 6.79 -7.25 0.65 0
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408787 135081555 1 FKH6C7 ABC6D7 -29.47 7.02 -7.22 0.63 1
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408788 135081556 1 OSiK2C9H18 ABC2D9E18 -71.16 14.54 -5.17 0.68 0
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408789 135081557 1 OSiC9H19 ABC9D19 -70.51 2.17 0.0 0.0 0
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408790 135081558 1 FKO2C8H8 ABC2D8E8 -91.25 8.02 -6.93 -0.05 0
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408791 135081559 1 KO2F3H6C8 AB2C3D6E8 -188.3 10.38 -7.44 -0.17 0
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408792 135081560 1 KF2O2H3C7 AB2C2D3E7 -153.88 6.74 -7.44 -0.15 0
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408793 135081561 1 FKH10C13 ABC10D13 -27.72 7.98 -6.17 0.04 0
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408794 135081562 1 FKH10C13 ABC10D13 -25.69 8.19 -6.52 -0.15 1
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408795 135081563 1 KC8H13 AB8C13 26.8 10.37 -5.47 0.2 1
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408796 135081564 1 KC9H15 AB9C15 25.06 8.55 -5.31 0.35 0
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408797 135081565 3 C3H5 A3B5 22.99 0.29 0.0 0.0 1
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408798 135081566 1 KC15H23 AB15C23 72.99 21.7 -3.91 -1.25 0
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408799 135081567 1 C15H23 A15B23 26.34 0.57 0.0 0.0 0
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408800 135081568 1 N2O2S2C5H6 A2B2C2D5E6 -55.26 1.85 -9.34 -1.58 0
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408801 135081569 1 NOH7C11 ABC7D11 36.43 7.39 -8.7 -1.8 0
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408802 135081570 1 SeN4H8C13 AB4C8D13 124.99 0.9 -8.39 -1.42 0
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408804 135081572 2 N2O4C24H27 A2B4C24D27 -180.55 23.09 -6.21 -2.76 0
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408805 135081573 1 LiNC8H8 ABC8D8 91.9 9.24 -7.52 1.44 0
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408806 135081574 1 NNaC8H8 ABC8D8 62.54 6.89 -6.89 0.57 0
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408807 135081575 1 KNC8H8 ABC8D8 48.58 8.51 -6.61 0.1 0
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408808 135081576 1 OH12C16 AB12C16 78.2 2.23 -8.9 -0.42 0
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408809 135081577 3 OC2H4 AB2C4 -57.99 2.44 -9.93 0.07 0
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408813 135081582 1 ClO2C11H15 AB2C11D15 -76.02 1.62 -8.94 0.1 0
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408814 135081583 1 O4C19H24 A4B19C24 -159.75 3.52 -10.2 -1.16 0
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408815 135081584 1 O2C21H22 A2B21C22 -14.39 4.38 -8.99 -0.22 0
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408816 135081585 1 O2C21H22 A2B21C22 -15.85 4.42 -8.85 -0.36 0
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408818 135081587 1 FeCl2N3C11H15 AB2C3D11E15 42.67 5.42 -8.3 -0.6 0
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408819 135081588 1 FeBr2N3C11H15 AB2C3D11E15 19.28 2.68 -7.93 -0.92 -1
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408820 135081589 1 FNNiOPH36C40 ABCDEF36G40 72.78 3.14 0.0 0.0 0
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408821 135081590 1 FNOC16H16 ABCD16E16 -43.0 3.52 -8.38 -1.24 0
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408822 135081592 1 ClNOC16H16 ABCD16E16 -5.96 4.04 -8.4 -1.28 0
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408823 135081593 1 ZrCl2H30C35 AB2C30D35 38.03 5.17 -8.38 -1.66 0
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408824 135081594 5 H6C7 A6B7 196.31 0.74 -7.44 -1.98 0
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408825 135081595 1 PdBr2N2C24H32 AB2C2D24E32 29.98 6.03 -7.72 -1.18 0
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408826 135081596 1 FeBr2N3C15H23 AB2C3D15E23 81.97 9.64 -6.92 -0.9 0
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408827 135081597 1 FeCl2N3C15H23 AB2C3D15E23 -112.22 8.83 -8.79 -0.84 0
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408828 135081598 3 H8C9 A8B9 127.86 0.62 -8.89 -0.23 0
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408830 135081600 1 NSiO2C24H25 ABC2D24E25 -37.22 5.32 -8.18 -0.48 0
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408831 135081601 1 INSC8H10 ABCD8E10 44.46 4.54 -8.54 -0.84 -1
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408832 135081602 1 NSiTiCl2C23H31 ABCD2E23F31 130.17 9.68 -8.1 -2.87 0
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408833 135081603 1 NSiC23H32 ABC23D32 -21.83 0.85 0.0 0.0 -2
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408835 135081605 1 BNSn2C15H36 ABC2D15E36 17.47 3.38 -7.65 -0.33 0
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408836 135081606 1 LiS2F3O4H6C8 AB2C3D4E6F8 -329.94 9.37 -10.38 -0.97 0
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408837 135081607 1 LiSe2C4H7 AB2C4D7 20.41 7.7 -6.76 1.0 0
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408838 135081608 1 SN3H9C11 AB3C9D11 100.12 3.39 -9.0 -0.78 0
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408839 135081609 1 SN3H11C16 AB3C11D16 134.54 3.15 -8.95 -0.97 0
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408840 135081610 1 NOC11H20 ABC11D20 -58.31 4.07 0.0 0.0 0
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408841 135081611 1 O3C7H12 A3B7C12 -144.31 3.0 -10.39 0.28 0
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408842 135081612 1 NSO5C19H33 ABC5D19E33 -256.31 3.38 -9.54 0.2 0