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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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219843 85164953 1 PN6O8C27H38 AB6C8D27E38 -293.13 15.37 0.0 0.0 0
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219844 85164954 1 PN5O8C21H22 AB5C8D21E22 -263.15 8.13 -9.85 -1.34 0
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219845 85164955 1 O11C32H46 A11B32C46 -445.42 6.01 -9.28 0.5 0
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219846 85164957 1 N2S2O7H30C31 A2B2C7D30E31 -190.78 3.8 -8.89 -0.98 0
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219847 85164958 2 O2H19C21 A2B19C21 -44.9 2.18 -8.48 -0.33 0
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219848 85164959 1 PN2Si2O9C25H49 AB2C2D9E25F49 -585.32 6.15 -8.97 0.0 0
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219849 85164960 1 SiO7C35H46 AB7C35D46 -256.4 3.81 -8.82 0.06 1
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219850 85164961 1 FSSiN4O5C29H44 ABCD4E5F29G44 -273.27 10.39 0.0 0.0 0
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219851 85164962 1 BO2Si2C36H75 AB2C2D36E75 -318.2 3.12 -8.62 0.59 0
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219852 85164963 1 BrN2O3H31C35 AB2C3D31E35 -12.7 4.85 -8.77 -0.59 0
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219853 85164964 1 ION3S3C25H26 ABC3D3E25F26 49.88 10.05 -7.75 -1.25 1
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219854 85164965 1 ON3S3C25H26 AB3C3D25E26 46.5 4.22 0.0 0.0 0
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219855 85164966 1 N5O9C29H45 A5B9C29D45 -388.01 2.54 -9.71 -0.03 0
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219856 85164967 1 N3O7C34H45 A3B7C34D45 -292.76 6.73 -8.66 -0.74 0
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219857 85164968 1 NO9C33H53 AB9C33D53 -305.08 4.65 -8.69 -0.29 0
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219858 85164969 1 NS2O8C30H41 AB2C8D30E41 -328.95 2.97 -8.79 -0.58 0
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219859 85164973 1 ISO9C23H29 ABC9D23E29 -300.72 2.84 -8.72 -0.9 0
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219860 85164974 1 BrSN3O6C27H34 ABC3D6E27F34 -237.57 4.98 -8.78 -0.9 0
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219861 85164975 1 S2F3O10C25H27 A2B3C10D25E27 -526.94 7.21 -8.84 -1.18 0
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219862 85164976 1 O5N6C34H36 A5B6C34D36 -119.07 5.86 -8.26 -0.19 -1
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219863 85164978 1 ClNiO2S4N7H16C20 ABC2D4E7F16G20 145.99 11.01 -8.4 -2.28 0
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219864 85164981 1 S4O5N9C21H23 A4B5C9D21E23 -38.8 10.27 -8.96 -1.08 0
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219865 85164982 1 NO6C38H43 AB6C38D43 -166.21 1.95 -9.3 0.05 0
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219866 85164983 1 O4N5C36H43 A4B5C36D43 -61.86 5.09 -8.68 0.22 0
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219867 85164984 1 SiN3O9C29H47 AB3C9D29E47 -413.13 7.74 -8.86 -1.52 0