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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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446952 135279067 1 BrFSN2O4H18C23 ABCD2E4F18G23 -35.12 7.75 -8.6 -1.1 0
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446953 135279070 1 PSF2O2N4H25C26 ABC2D2E4F25G26 -93.23 2.26 -8.55 -0.66 0
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446954 135279076 1 N2O2C21H30 A2B2C21D30 -61.58 4.6 -9.02 -0.45 0
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446955 135279080 1 INSF2O4H16C19 ABCD2E4F16G19 -190.74 6.21 -9.23 -2.54 0
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446956 135279088 1 N3C14H29 A3B14C29 -11.65 2.05 -8.15 2.56 0
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446957 135279095 1 O3N4C21H42 A3B4C21D42 -124.81 1.6 -8.37 1.85 0
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446958 135279097 1 ClN5O6C38H46 AB5C6D38E46 -230.82 11.42 -9.3 -0.73 0
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446959 135279098 1 ON3C14H17 AB3C14D17 -11.37 4.74 -8.4 -0.27 0
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446960 135279116 1 NS2O3C6H13 AB2C3D6E13 -94.64 3.52 -9.29 -1.37 0
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446961 135279118 1 OSN2C20H22 ABC2D20E22 31.58 2.58 -8.49 -0.36 0
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446962 135279134 1 O5N7C31H39 A5B7C31D39 -140.77 6.06 -8.52 -0.51 0
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446963 135279148 2 N2O3C12H15 A2B3C12D15 -225.93 6.17 -9.02 -1.05 0
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446964 135279150 1 OSF2C8H8 ABC2D8E8 -107.27 3.7 -9.17 -0.98 1
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446965 135279153 1 NOC16H32 ABC16D32 -53.11 1.95 0.0 0.0 1
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446966 135279154 1 NOC14H30 ABC14D30 -46.68 3.15 0.0 0.0 0
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446967 135279165 1 N2O5C31H38 A2B5C31D38 -84.44 4.68 -8.52 0.04 0
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446968 135279166 1 ON4C36H36 AB4C36D36 116.12 4.06 -8.43 -0.36 0
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446969 135279173 2 NO5C17H36 AB5C17D36 -500.45 2.23 -9.02 1.01 0
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446970 135279198 1 ON5H23C24 AB5C23D24 82.85 6.94 -8.82 -0.81 0
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446971 135279214 1 O3N5C18H31 A3B5C18D31 -37.17 4.72 -8.24 0.0 0
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446972 135279219 2 O2C12H15 A2B12C15 -151.78 3.13 -9.16 -0.48 0
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446973 135279239 1 FO3N6C26H35 AB3C6D26E35 -111.87 1.29 -8.8 -0.8 0
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446974 135279240 1 FO3N6C26H35 AB3C6D26E35 -110.99 2.31 -8.75 -0.75 0
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446975 135279241 1 FO3N6C26H37 AB3C6D26E37 -131.82 2.11 -8.65 -0.32 0
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446976 135279242 1 N5O5C42H43 A5B5C42D43 -104.61 8.27 -8.49 -0.84 0