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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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411827 135084672 1 VN2O4C36H55 AB2C4D36E55 -255.73 2.99 -6.58 -0.65 0
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411828 135084673 1 ZnN2C13H26 AB2C13D26 27.62 1.44 -7.86 -1.79 0
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411829 135084674 2 NOPH21C27 ABCD21E27 112.94 2.99 -8.63 -0.44 0
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411830 135084675 1 ON3F6C17H21 AB3C6D17E21 -358.21 6.44 -8.87 -1.12 0
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411831 135084676 1 N2O2C29H48 A2B2C29D48 -84.99 2.43 -7.8 1.36 0
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411832 135084677 1 OPPdI2N3C29H34 ABCD2E3F29G34 170.13 6.75 -7.32 -0.36 1
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411833 135084678 1 FN2O2C27H32 AB2C2D27E32 -46.19 3.92 0.0 0.0 0
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411834 135084679 2 NC17H18 AB17C18 95.89 2.24 -8.58 0.22 0
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411835 135084680 1 AlN2S2O4F6H15C17 AB2C2D4E6F15G17 -450.96 3.29 -9.75 -1.09 1
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411836 135084681 1 AuClNPO4H55C62 ABCDE4F55G62 69.93 10.13 0.0 0.0 0
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411837 135084682 1 NPO4H54C62 ABC4D54E62 19.2 3.4 -8.6 -0.49 0
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411840 135084685 1 NO2C11H13 AB2C11D13 -75.63 1.28 -9.76 -0.31 -2
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411841 135084686 1 ClRuN4C10H17 ABC4D10E17 79.02 17.84 -7.88 -2.01 0
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411842 135084687 1 BrMgSC2H5 ABCD2E5 -59.08 2.53 -9.12 -0.32 0
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411843 135084688 1 CCs2H6O6 AB2C6D6 -414.11 19.26 -9.3 0.27 0
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411844 135084689 1 FNC16O20H76 ABC16D20E76 -1368.05 8.72 -11.21 -0.17 0
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411845 135084690 1 ZnI2N2C6H16 AB2C2D6E16 2.18 1.84 -8.07 -0.83 0
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411846 135084691 1 BrOC12H15 ABC12D15 -22.24 2.03 -9.62 -0.06 0
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411847 135084692 1 SC13H16 AB13C16 50.81 2.03 -8.2 -0.22 0
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411848 135084693 1 FNOC12H14 ABCD12E14 -72.11 4.82 -8.46 0.12 0
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411849 135084694 1 NSO2C9H11 ABC2D9E11 -44.12 3.27 -7.84 -0.32 1
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411850 135084695 1 PO4C10H12 AB4C10D12 -165.54 3.55 0.0 0.0 0
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411851 135084696 1 O4C11H20 A4B11C20 -207.38 2.48 -10.38 0.24 0
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411853 135084698 1 ClN2H10C12 AB2C10D12 56.98 2.27 0.0 0.0 0
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411854 135084699 2 O2C6H9 A2B6C9 -136.4 1.89 -9.92 -0.47 0