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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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137912 52283098 1 SO2N4C18H26 AB2C4D18E26 -59.99 5.27 -8.9 -0.47 1
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137913 52283540 1 FO3N6C22H22 AB3C6D22E22 -75.03 3.42 0.0 0.0 0
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137914 52283593 1 SN3O3C19H23 AB3C3D19E23 -90.17 8.83 -8.27 0.13 1
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137915 52283614 1 OSN2C16H23 ABC2D16E23 14.97 4.02 0.0 0.0 0
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137916 52283615 1 OSN2C16H22 ABC2D16E22 -1.26 1.7 -8.79 -0.24 1
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137917 52283735 1 SN4O4C22H31 AB4C4D22E31 -114.22 5.96 0.0 0.0 0
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137918 52283945 1 FO2N3C21H28 AB2C3D21E28 -143.25 5.42 -8.49 0.0 0
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137919 52283946 1 FO2N3C21H28 AB2C3D21E28 -143.1 5.36 -8.51 -0.01 0
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137920 52283947 1 FN3O3C23H30 AB3C3D23E30 -139.34 4.18 -8.91 -0.08 0
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137921 52283948 1 FN3O3C23H30 AB3C3D23E30 -138.3 3.94 -8.83 -0.04 0
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137922 52283949 1 NO3C16H17 AB3C16D17 -72.09 2.38 -9.07 -1.04 0
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137923 52283950 1 NO3C16H17 AB3C16D17 -72.76 2.39 -8.99 -0.98 1
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137924 52284027 1 ClSN2C16H20 ABC2D16E20 74.97 5.18 0.0 0.0 1
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137925 52284248 1 O2N6C24H31 A2B6C24D31 0.81 3.58 0.0 0.0 1
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137926 52284276 1 SN2O3C19H27 AB2C3D19E27 -75.25 7.11 0.0 0.0 0
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137927 52284678 1 N3O5C22H29 A3B5C22D29 -175.81 5.33 -8.48 0.01 0
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137928 52284970 1 SN2O6C21H28 AB2C6D21E28 -246.09 6.39 -8.98 0.04 0
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137929 52285593 1 O3N4C22H32 A3B4C22D32 -127.07 5.58 -9.21 -0.35 0
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137930 52285594 1 O3N4C22H32 A3B4C22D32 -125.83 4.65 -9.05 -0.4 0
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137931 52285595 1 SN3O3C22H23 AB3C3D22E23 -56.07 5.64 -8.48 -0.66 0
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137932 52285831 1 F2N2O2S2C15H18 A2B2C2D2E15F18 -124.65 9.59 -8.99 -0.69 0
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137933 52286595 1 ON5H21C22 AB5C21D22 83.05 3.39 -9.21 -0.27 0
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137934 52286975 1 NSO2C14H21 ABC2D14E21 -79.73 4.41 -9.47 0.07 0
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137935 52287478 1 O2N3C22H27 A2B3C22D27 -50.73 5.86 -8.55 -0.02 0
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137936 52287479 1 O2N3C23H31 A2B3C23D31 -67.36 8.08 -8.77 0.0 1