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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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193869 78449754 1 FN2O4C19H19 AB2C4D19E19 -180.68 2.26 -9.2 -0.5 0
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193870 78449755 1 ClN2O5C20H21 AB2C5D20E21 -183.92 4.33 -8.78 -0.53 0
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193871 78449756 1 N2O4C19H26 A2B4C19D26 -183.41 3.61 -9.81 -0.13 0
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193872 78449757 1 N3O6C19H19 A3B6C19D19 -139.54 7.25 -9.64 -1.4 -1
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193873 78449996 1 N6O7C24H27 A6B7C24D27 -211.98 2.87 0.0 0.0 -1
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193874 78450107 1 NO4C22H30 AB4C22D30 -146.29 4.88 0.0 0.0 0
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193875 78450108 1 NO4C22H31 AB4C22D31 -202.73 7.01 -9.11 -0.08 -1
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193876 78450109 1 NO4C24H28 AB4C24D28 -114.46 2.88 0.0 0.0 0
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193877 78450399 1 SO2N3C20H21 AB2C3D20E21 1.86 5.24 -8.42 -1.67 0
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193878 78450501 1 FOSN3C21H22 ABCD3E21F22 -10.47 10.13 -8.44 -1.65 0
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193879 78450502 1 OSN3C22H25 ABC3D22E25 28.18 6.98 -8.6 -1.55 0
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193880 78450503 1 OSN3C21H23 ABC3D21E23 27.81 6.64 -8.36 -1.64 0
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193881 78450504 1 OSN3C21H23 ABC3D21E23 21.68 7.6 -8.44 -0.56 0
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193882 78450505 1 OSN3C21H23 ABC3D21E23 22.36 7.67 -8.43 -0.52 0
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193883 78450592 1 ClSO2N3C19H26 ABC2D3E19F26 -88.48 8.05 -8.55 -0.32 0
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193884 78450898 1 FN3O5H16C19 AB3C5D16E19 -202.96 4.67 -9.63 -0.99 0
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193885 78450968 1 FN3O5H18C19 AB3C5D18E19 -189.3 1.49 -8.39 -0.46 0
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193886 78450969 1 N3O6C20H21 A3B6C20D21 -189.17 2.37 -8.44 -0.43 0
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193887 78450970 1 N3O6C20H21 A3B6C20D21 -184.33 3.15 -8.34 -0.34 0
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193888 78450971 1 F2N3O5H17C19 A2B3C5D17E19 -234.86 1.67 -8.56 -0.62 0
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193889 78450972 1 ClN3O5H18C19 AB3C5D18E19 -153.0 1.62 -8.39 -0.5 0
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193890 78450973 1 FN3O5H18C19 AB3C5D18E19 -194.99 3.4 -8.5 -0.52 -1
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193891 78451427 1 ClNO6C23H25 ABC6D23E25 -204.06 2.56 0.0 0.0 1
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193892 78451593 1 F3N6C18H26 A3B6C18D26 -77.7 4.87 0.0 0.0 1
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193893 78451775 1 FO2N4C24H30 AB2C4D24E30 -58.07 13.11 0.0 0.0 1