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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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138963 52449741 1 OSN5C14H19 ABC5D14E19 39.97 7.7 -9.37 -0.9 0
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138964 52449941 1 NO5C16H19 AB5C16D19 -193.83 4.86 -9.87 -1.54 0
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138965 52451011 1 FNSO5H20C23 ABCD5E20F23 -179.44 6.87 -9.1 -1.02 0
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138966 52451154 2 NO2C6H9 AB2C6D9 -174.78 5.18 -10.06 -0.1 0
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138967 52451167 1 N2O3C17H20 A2B3C17D20 -75.33 3.07 -8.9 -0.67 0
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138968 52451344 1 SO4N7H19C20 AB4C7D19E20 -49.87 12.26 -9.09 -1.88 0
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138969 52451557 1 N3O4C17H21 A3B4C17D21 -110.49 4.14 -8.4 -0.05 0
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138970 52452574 1 SO2N3C21H25 AB2C3D21E25 -36.05 6.52 -8.51 -0.77 0
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138971 52453104 1 SN3O3C22H25 AB3C3D22E25 -93.59 7.8 -8.8 -0.98 0
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138972 52453105 1 SN3O3C25H25 AB3C3D25E25 -65.14 7.24 -8.92 -1.08 0
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138973 52453112 1 SN3O3C22H25 AB3C3D22E25 -93.85 7.2 -8.78 -0.98 0
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138974 52453336 1 N3O4C24H31 A3B4C24D31 -157.18 5.1 -8.73 -0.33 0
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138975 52453449 1 FN3O3C19H24 AB3C3D19E24 -160.67 5.94 -9.0 -0.23 0
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138976 52453450 1 SN3O4C17H23 AB3C4D17E23 -87.87 5.51 -9.45 -1.57 0
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138977 52453451 1 SN3O4C17H23 AB3C4D17E23 -83.22 8.5 -9.36 -1.61 1
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138978 52453516 1 FO2N3C21H25 AB2C3D21E25 -74.65 3.14 0.0 0.0 1
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138979 52453775 1 N3O3C21H22 A3B3C21D22 -28.53 25.33 0.0 0.0 0
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138980 52453776 1 FN4O4C18H23 AB4C4D18E23 -211.15 3.81 -9.54 -0.05 1
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138981 52453777 1 BrON3C19H23 ABC3D19E23 30.24 4.63 0.0 0.0 1
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138982 52453778 1 ClO2N3C20H25 AB2C3D20E25 -15.03 6.09 0.0 0.0 0
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138983 52453779 1 ClO2N3C20H24 AB2C3D20E24 -41.12 5.08 -8.64 -0.22 1
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138984 52453871 1 ClON3C21H27 ABC3D21E27 2.05 4.31 0.0 0.0 1
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138985 52454364 1 O2N6C21H21 A2B6C21D21 43.02 3.96 0.0 0.0 0
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138986 52455295 1 SN2O4C23H30 AB2C4D23E30 -140.8 2.92 -9.41 -0.78 0
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138987 52455296 1 BrNOC19H22 ABCD19E22 -16.83 3.97 -9.47 -0.24 1