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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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59749 24895551 1 SN3O6H23C24 AB3C6D23E24 -158.5 7.92 -9.05 -1.13 0
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59750 24895648 1 SF3O3N4C18H19 AB3C3D4E18F19 -181.28 2.54 -9.72 -1.36 0
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59751 24895665 1 Cl3N3O4C26H34 A3B3C4D26E34 -227.06 3.26 -8.92 -0.82 0
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59752 24895673 1 ClS2O11N15C56H70 AB2C11D15E56F70 -424.04 8.3 -8.69 -1.56 0
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59753 24895684 1 Si2O4N5C30H53 A2B4C5D30E53 -247.2 4.24 -8.95 -0.9 0
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59754 24895853 1 ICl2N2F3O4H16C21 AB2C2D3E4F16G21 -243.79 3.69 -10.08 -1.62 0
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59755 24895893 1 FNOSH12C16 ABCDE12F16 -27.93 2.21 -8.84 -0.84 0
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59756 24895894 1 NOSCl2H11C16 ABCD2E11F16 5.57 2.7 -8.92 -1.11 0
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59757 24896077 1 BrN2O2C44H89 AB2C2D44E89 -195.09 48.07 -4.91 -0.95 0
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59758 24896095 1 SO5N6C24H32 AB5C6D24E32 -132.52 13.46 -9.17 -1.36 0
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59759 24896100 2 FON2C12H12 ABC2D12E12 -52.8 2.16 -9.49 -0.66 0
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59760 24896102 1 N2O4F9C32H35 A2B4C9D32E35 -643.7 4.81 -9.15 -1.48 0
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59761 24896113 1 N3O3C25H31 A3B3C25D31 -91.92 4.78 -9.01 -0.44 0
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59762 24896131 1 As2F2S4O5H16C24 A2B2C4D5E16F24 2.92 6.96 -8.57 -2.85 0
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59763 24896203 1 O2N4C29H46 A2B4C29D46 -103.88 8.26 -8.75 -0.39 0
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59764 24896226 1 SN6O6C27H36 AB6C6D27E36 -161.05 13.32 -8.81 -1.35 0
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59765 24896245 1 PSN3F4O5C25H28 ABC3D4E5F25G28 -414.28 5.06 -9.22 -1.11 0
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59766 24896323 1 SO2F3N4C27H33 AB2C3D4E27F33 -184.51 6.66 -8.72 -0.75 0
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59767 24896390 1 ON2C16H32 AB2C16D32 -105.28 3.96 -9.24 1.09 0
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59768 24896450 1 N2O5F9H23C25 A2B5C9D23E25 -666.45 5.18 -9.64 -1.44 0
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59769 24896460 1 SO2N4C21H24 AB2C4D21E24 -11.31 8.69 -8.53 -0.49 0
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59770 24896466 1 SO2N5C24H27 AB2C5D24E27 18.96 4.24 -7.86 -0.91 0
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59771 24896525 1 Cl2N2F3O4H21C27 A2B2C3D4E21F27 -232.07 5.79 -9.65 -1.07 0
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59772 24896544 1 SF3N3O3C22H26 AB3C3D3E22F26 -234.99 3.09 -9.26 -0.66 0
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59774 24896606 1 ClO2N4C30H39 AB2C4D30E39 -43.4 1.39 -8.51 0.01 0
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59775 24896637 1 N6O15C59H62 A6B15C59D62 -452.11 11.2 -8.7 -0.91 0
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59776 24896775 1 SF2N2O2H18C21 AB2C2D2E18F21 -114.92 6.98 -9.62 -1.02 0
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59777 24896796 1 NSO4C21H25 ABC4D21E25 -138.98 6.43 -8.75 -1.22 0
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59778 24896799 2 NOC9H12 ABC9D12 -35.87 3.45 -7.99 0.32 0
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59779 24896805 1 SN7H15C16 AB7C15D16 113.87 3.2 -8.6 -0.65 0
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59780 24896815 1 N3O3C29H37 A3B3C29D37 -32.76 4.62 -8.35 -0.78 0
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59781 24896866 1 ClON4H23C24 ABC4D23E24 52.24 3.97 -8.57 -0.64 0
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59782 24896906 1 ClNO4H6C8 ABC4D6E8 -43.63 3.73 -10.6 -1.8 0
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59783 24896990 2 N2C11H13 A2B11C13 74.13 6.31 -8.74 -0.42 0
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59784 24897065 2 N3O5C13H19 A3B5C13D19 -451.88 7.62 -9.78 -0.64 0
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59785 24897099 1 ON7C28H31 AB7C28D31 50.35 4.28 -8.53 -0.53 0
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59786 24897125 1 MnS2N4F6O6C16H24 AB2C4D6E6F16G24 -387.56 12.4 0.0 0.0 0
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59787 24897149 1 N2O3C19H20 A2B3C19D20 -18.44 4.35 -8.5 -0.06 0
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59788 24897159 1 ClNO2H10C15 ABC2D10E15 78.01 2.98 -9.39 -1.64 0
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59789 24897172 1 N2O7C35H48 A2B7C35D48 -289.48 5.33 -8.86 -0.14 0
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59790 24897288 1 O2S2F3N3H16C23 A2B2C3D3E16F23 -128.43 4.36 -8.99 -1.61 0
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59791 24897322 1 N9O22C34H61 A9B22C34D61 -912.41 12.2 -9.38 -0.58 0
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59792 24897361 1 S2N3O3C16H21 A2B3C3D16E21 -83.4 5.73 -9.4 -1.42 0
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59793 24897371 1 SN4O4C15H16 AB4C4D15E16 -63.82 2.93 -8.99 -0.96 0
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59794 24897494 1 F4N8H18C21 A4B8C18D21 -49.55 1.56 -8.64 -0.82 0
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59795 24897503 1 ClO2S2F3N3H19C21 AB2C2D3E3F19G21 -186.64 5.77 -8.9 -1.66 0
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59796 24897518 1 ClFSN3C23H25 ABCD3E23F25 21.68 2.15 -8.62 -0.81 0
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59797 24897666 1 SO3N6C23H28 AB3C6D23E28 7.86 4.69 -8.32 -0.77 0
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59798 24897709 1 SN4O8C33H42 AB4C8D33E42 -271.03 6.83 -9.08 -0.52 1
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59799 24897718 1 NS3O8C19H24 AB3C8D19E24 -294.09 2.44 0.0 0.0 0
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59800 24897723 1 NO5C26H31 AB5C26D31 -139.12 3.81 -8.33 -0.41 0
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59801 24897753 1 Cl3F3N3S3O5H15C22 A3B3C3D3E5F15G22 -277.69 10.11 -8.86 -1.67 0
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59802 24897762 1 ON7C38H43 AB7C38D43 69.91 5.65 -8.48 -0.38 0
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59803 24897817 2 O4C18H19 A4B18C19 -286.71 6.68 -9.73 -0.71 0
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59804 24897834 1 O2F3N6H17C21 A2B3C6D17E21 -122.0 9.24 -8.43 -0.76 0
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59805 24897837 1 O2S2N4H10C15 A2B2C4D10E15 55.83 3.6 -8.98 -1.43 0
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59806 24897839 1 O2S2N5H9C17 A2B2C5D9E17 88.01 2.88 -9.05 -1.85 0
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59807 24897846 1 SCl2N2O2C17H18 AB2C2D2E17F18 -60.66 3.27 -8.77 -1.02 0
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59808 24897876 1 F2N2O2H14C21 A2B2C2D14E21 -29.2 4.11 -9.2 -1.36 0
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59809 24897975 1 SO2N3H23C25 AB2C3D23E25 0.99 4.72 -8.55 -1.2 0
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59810 24898014 1 SiN2O4C28H42 AB2C4D28E42 -230.62 2.11 -9.04 0.01 0
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59811 24898019 1 SN3O3Cl4C20H31 AB3C3D4E20F31 -192.54 3.28 -9.28 -0.41 0
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59812 24898020 1 Si2O9C37H62 A2B9C37D62 -505.44 1.23 -8.89 -0.91 0
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59813 24898135 1 OSN6C19H20 ABC6D19E20 80.19 4.82 -8.7 -0.77 0
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59814 24898157 1 N2O2F4C29H30 A2B2C4D29E30 -245.0 6.09 -8.16 -0.4 0
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59815 24898226 1 SiO2N3C22H27 AB2C3D22E27 -36.68 3.14 -8.9 -0.82 0
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59816 24898305 1 N2O4C9H18 A2B4C9D18 -191.96 3.61 -9.31 0.38 0
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59817 24898364 1 SN3O9C33H53 AB3C9D33E53 -433.85 7.46 -8.89 -1.04 0
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59818 24898416 1 NaS2N5O10C26H40 AB2C5D10E26F40 -503.63 8.92 -9.09 -1.23 0
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59819 24898436 1 N8O8C31H56 A8B8C31D56 -428.52 5.96 -9.48 0.38 0
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59820 24898450 1 NSO2C15H17 ABC2D15E17 -35.16 5.45 -9.28 -0.81 0
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59821 24898455 1 ClNO7C20H22 ABC7D20E22 -230.45 1.98 -9.03 -0.69 0
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59822 24898504 1 OSN6C23H24 ABC6D23E24 86.91 7.29 -9.41 -1.39 0
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59823 24898538 1 SF2O2N7C22H23 AB2C2D7E22F23 -56.53 3.54 -9.02 -1.09 0
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59824 24898578 1 S2O3N5C22H25 A2B3C5D22E25 -47.68 9.13 -8.16 -0.69 0
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59825 24898724 1 ClON7C18H22 ABC7D18E22 49.95 7.73 -9.18 -1.48 0
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59826 24898746 1 BrClSN3C15H15 ABCD3E15F15 67.24 4.76 -8.76 -0.73 0
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59827 24898751 1 OF4N4H20C25 AB4C4D20E25 -99.68 7.29 -8.98 -1.15 0
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59828 24898823 1 BrNO4H16C20 ABC4D16E20 -91.19 5.26 -8.37 -0.55 0
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59829 24898889 1 NO3C15H15 AB3C15D15 -77.48 5.61 -8.66 -0.46 0
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59830 24898892 1 Si2N5O5C25H47 A2B5C5D25E47 -299.67 10.51 -9.14 -0.26 0
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59831 24898959 1 PO4N5C18H24 AB4C5D18E24 -168.36 6.77 -8.8 -0.4 0
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59832 24898975 1 ClSO2N3C20H24 ABC2D3E20F24 -44.01 4.58 -8.78 -0.97 0
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59833 24898976 1 BrSN7C19H22 ABC7D19E22 103.85 7.15 -8.36 -1.25 0
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59834 24899005 1 NOC21H23 ABC21D23 7.19 0.49 -8.58 0.07 0
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59835 24899017 1 SF3N3O3C14H18 AB3C3D3E14F18 -275.44 6.56 -9.28 -0.54 0
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59836 24899034 1 OSN5C20H21 ABC5D20E21 46.97 4.73 -8.66 -0.85 0
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59837 24899039 1 NO3C23H23 AB3C23D23 -82.22 1.96 -8.84 -0.65 0
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59838 24899384 1 O7C20H22 A7B20C22 -253.49 1.96 -8.54 -0.1 0
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59839 24899390 1 HNOSF4C8 ABCDE4F8 -144.09 1.26 -9.88 -2.14 0
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59840 24899422 1 CoO4C20H38 AB4C20D38 -265.68 29.75 0.0 0.0 0
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59841 24899439 1 ClSN2O4C19H21 ABC2D4E19F21 -131.59 4.21 -8.73 -0.85 0
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59842 24899441 1 ClSN2O3C20H25 ABC2D3E20F25 -98.85 4.68 -8.59 -0.5 0
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59843 24899463 1 FSN2O3H25C27 ABC2D3E25F27 -87.06 4.68 -8.75 -0.8 0
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59845 24899658 1 O25C63H110 A25B63C110 -1235.37 5.95 -9.74 0.01 0
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59846 24899677 1 N2O3C18H38 A2B3C18D38 -200.72 4.62 -9.48 1.72 0
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59847 24899732 1 ON2F4H10C20 AB2C4D10E20 -84.37 4.3 -9.22 -1.45 0
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59848 24899749 1 ClO2N4H15C16 AB2C4D15E16 12.03 4.56 -8.92 -1.44 0
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59849 24899810 2 ON3C15H16 AB3C15D16 32.04 5.15 -8.27 -0.62 0
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59850 24899826 1 S2O5N7C31H31 A2B5C7D31E31 -61.18 9.95 -8.31 -0.85 0