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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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134086 51639714 1 O2N5C15H24 A2B5C15D24 -60.56 3.89 0.0 0.0 0
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134087 51640545 1 N2O3C22H28 A2B3C22D28 -89.42 4.27 -8.65 -0.39 0
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134088 51640796 1 OBr2N2C15H20 AB2C2D15E20 -37.42 3.5 -9.03 -0.63 0
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134089 51640963 1 ClFO2N5C24H29 ABC2D5E24F29 -81.79 3.59 -8.33 -0.98 1
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134090 51642140 1 ClFSO2N3H20C22 ABCD2E3F20G22 -28.76 7.46 0.0 0.0 0
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134091 51642509 1 OSF3N5C17H20 ABC3D5E17F20 -128.49 6.19 -9.3 -0.97 0
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134092 51642510 1 S2N3O4C23H27 A2B3C4D23E27 -67.92 8.4 -9.05 -0.86 0
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134093 51642531 1 S2N3O5C23H31 A2B3C5D23E31 -162.39 6.17 -8.58 -1.3 2
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134094 51642910 1 O3N4C28H36 A3B4C28D36 -10.15 18.2 -6.31 -1.73 1
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134095 51643048 1 ClSO2N5C24H29 ABC2D5E24F29 12.04 7.49 0.0 0.0 0
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134096 51643559 1 ClOS2N5C22H24 ABC2D5E22F24 51.1 2.59 -8.65 -1.17 0
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134097 51643659 1 N2O5C23H26 A2B5C23D26 -120.54 5.77 -8.93 -1.29 0
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134098 51643789 1 S2N3O4C23H31 A2B3C4D23E31 -126.26 3.94 -8.99 -0.65 0
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134099 51644054 1 SN3O3C20H29 AB3C3D20E29 -111.67 12.44 -9.72 -1.01 0
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134100 51644055 1 SN3O3C20H29 AB3C3D20E29 -112.43 7.59 -9.75 -1.15 0
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134101 51644056 1 SN3O3C20H29 AB3C3D20E29 -114.43 6.33 -9.64 -1.23 0
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134102 51644151 1 F2N2S2O3C22H24 A2B2C2D3E22F24 -182.78 4.33 -8.81 -1.02 0
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134103 51644436 1 FO4N5H20C23 AB4C5D20E23 -83.16 7.07 -9.62 -1.04 0
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134104 51644536 1 FNSO3H18C19 ABCD3E18F19 -80.3 2.9 -9.19 -0.63 0
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134105 51644582 1 ON5C23H37 AB5C23D37 -13.35 5.47 -8.8 -0.14 1
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134106 51644583 1 ON5C23H38 AB5C23D38 8.46 7.31 0.0 0.0 0
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134107 51644584 1 ON5C23H37 AB5C23D37 -15.87 6.27 -8.92 0.02 0
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134108 51644614 1 N4O5C26H28 A4B5C26D28 -148.26 1.78 -8.77 -0.76 -3
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134109 51644615 1 S2N6O12C20H29 A2B6C12D20E29 -479.07 6.61 0.0 0.0 0
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134110 51644918 1 NSO6C23H31 ABC6D23E31 -240.71 9.3 -9.02 -0.87 0