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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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139088 52470531 1 N3O5C24H34 A3B5C24D34 -141.31 3.94 0.0 0.0 0
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139089 52470532 1 N3O5C24H33 A3B5C24D33 -162.41 4.2 -8.21 -0.27 0
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139090 52470584 1 N3O4C25H31 A3B4C25D31 -66.12 3.18 -8.69 -0.25 0
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139091 52470614 2 N2O2C11H12 A2B2C11D12 -99.74 6.73 -8.35 -0.51 0
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139092 52470615 2 N2O2C11H12 A2B2C11D12 -99.42 6.79 -8.2 -0.44 1
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139093 52470891 1 O2N4C23H29 A2B4C23D29 12.04 5.14 0.0 0.0 0
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139094 52471345 2 ON2F3C7H8 AB2C3D7E8 -375.19 8.86 -9.83 -0.16 0
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139095 52471346 1 SO2N3C21H27 AB2C3D21E27 -43.67 1.07 -9.03 -0.67 0
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139096 52471495 1 N3O3C20H23 A3B3C20D23 -66.59 3.89 -8.15 -0.38 1
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139097 52471704 1 ON5C24H36 AB5C24D36 15.98 12.54 0.0 0.0 0
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139098 52471734 1 OSN3C15H21 ABC3D15E21 -6.52 4.04 -8.87 -0.38 0
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139099 52472252 1 O2S2N3C18H19 A2B2C3D18E19 -17.24 4.48 -9.07 -0.89 0
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139100 52472253 1 O2S2N3C18H19 A2B2C3D18E19 -18.96 3.78 -9.17 -0.87 0
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139101 52472343 2 NOC8H13 ABC8D13 -102.53 1.98 -8.17 0.22 -1
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139102 52472344 1 N2O2H23C28 A2B2C23D28 30.9 6.95 0.0 0.0 0
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139103 52472810 1 N3O3C26H37 A3B3C26D37 -101.49 3.46 -8.46 -0.26 1
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139104 52472811 1 N3O3C26H38 A3B3C26D38 -82.24 3.66 0.0 0.0 0
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139105 52472921 1 O3N5C24H31 A3B5C24D31 -48.6 6.3 -9.44 -0.71 0
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139106 52473163 1 FSN2O6C19H25 ABC2D6E19F25 -287.59 5.44 -9.12 -0.39 0
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139107 52473578 1 OS3N4C19H22 AB3C4D19E22 41.73 8.13 -8.78 -1.16 0
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139108 52473618 1 O2S2N5C18H21 A2B2C5D18E21 34.78 9.51 -8.8 -1.23 0
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139109 52474484 1 OS2F3N3H16C18 AB2C3D3E16F18 -122.77 5.05 -9.28 -1.74 1
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139110 52475081 1 N2O4C18H25 A2B4C18D25 -75.5 6.18 0.0 0.0 0
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139111 52475082 2 NO2C9H12 AB2C9D12 -64.67 5.52 -9.16 -1.11 0
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139112 52475570 1 ClSO2N3C17H18 ABC2D3E17F18 -44.84 7.42 -8.77 -0.61 0