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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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37103 8016931 1 NSO5H15C16 ABC5D15E16 -155.26 3.22 -8.89 -1.17 0
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37104 8016934 1 SO3N4C17H22 AB3C4D17E22 -35.83 2.69 -9.06 -1.19 0
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37105 8016946 1 ClSN2O2H17C19 ABC2D2E17F19 -15.72 3.11 -9.07 -0.78 1
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37106 8016955 1 Cl2N2O2C19H27 A2B2C2D19E27 -78.97 4.51 0.0 0.0 0
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37107 8016957 1 SN3O5C20H27 AB3C5D20E27 -219.61 8.71 -9.45 -0.62 0
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37108 8016964 1 F3N3O3C17H20 A3B3C3D17E20 -279.83 4.55 -10.02 -0.43 0
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37109 8016987 1 NCl2O2C15H21 AB2C2D15E21 -100.45 2.82 -8.99 -0.48 1
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37110 8017004 1 NO3C21H34 AB3C21D34 -96.23 3.55 0.0 0.0 1
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37111 8017006 1 NO3C21H34 AB3C21D34 -96.13 2.49 0.0 0.0 0
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37112 8017023 1 NO4C17H29 AB4C17D29 -162.2 2.45 -8.26 0.28 1
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37113 8017044 1 Cl2O2N4H13C15 A2B2C4D13E15 33.56 7.24 0.0 0.0 1
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37114 8017046 1 BrFO2N4H13C15 ABC2D4E13F15 8.14 4.35 0.0 0.0 0
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37115 8017053 1 BrO2N4H13C15 AB2C4D13E15 59.21 7.18 -9.85 -0.67 1
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37116 8017054 1 O4N5H14C15 A4B5C14D15 45.99 5.87 0.0 0.0 0
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37117 8017084 1 OSN2C15H20 ABC2D15E20 -38.58 4.18 -8.83 -0.65 1
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37118 8017087 1 OSN3C20H24 ABC3D20E24 12.93 17.2 0.0 0.0 0
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37119 8017106 1 N2O5H16C21 A2B5C16D21 -142.6 5.43 -9.09 -1.82 1
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37120 8017108 1 SO2N3C23H26 AB2C3D23E26 10.68 7.84 0.0 0.0 0
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37121 8017117 1 ClSN3O5H12C17 ABC3D5E12F17 -66.26 5.98 -9.8 -1.85 1
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37122 8017121 1 NO3C19H34 AB3C19D34 -124.33 2.21 0.0 0.0 0
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37123 8017187 1 OS2N3C16H19 AB2C3D16E19 18.37 5.78 -8.51 -1.02 0
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37124 8017189 1 NSO2C13H21 ABC2D13E21 -97.91 5.49 -9.43 -0.4 0
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37125 8017192 1 SN3O3C23H25 AB3C3D23E25 -68.58 4.29 -8.88 -0.75 2
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37126 8017197 1 BrFON3C19H23 ABCD3E19F23 45.73 16.09 -5.16 -0.97 0
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37127 8017198 1 N3O4C23H25 A3B4C23D25 -131.38 6.33 -8.45 -0.32 0
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37128 8017213 1 ClSN2O4H19C20 ABC2D4E19F20 -81.2 1.95 -8.25 -0.75 0
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37129 8017225 1 SO2N4H14C20 AB2C4D14E20 107.3 5.14 -9.58 -1.86 0
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37130 8017260 1 SN2O2C16H16 AB2C2D16E16 -9.59 4.12 -8.16 -0.75 0
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37131 8017263 1 N2S2O3C19H22 A2B2C3D19E22 -87.93 4.48 -8.68 -1.18 0
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37132 8017264 2 NOSC10H12 ABCD10E12 -63.48 6.38 -8.56 -1.09 0
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37133 8017273 1 SN3O3C20H25 AB3C3D20E25 -67.05 6.39 -8.76 -0.39 0
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37134 8017300 1 SO2N3C18H21 AB2C3D18E21 -21.31 7.5 -8.6 -0.4 0
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37135 8017301 1 OSF3N3C22H24 ABC3D3E22F24 -158.55 8.63 -8.84 -1.17 0
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37136 8017302 1 SO2N3C19H23 AB2C3D19E23 -20.88 8.8 -8.7 -0.8 0
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37137 8017313 1 ClS2N4C16H17 AB2C4D16E17 68.78 8.43 -8.72 -1.14 0
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37138 8017345 1 ClSO3N4H11C14 ABC3D4E11F14 28.46 2.98 -9.52 -1.94 0
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37139 8017349 1 SN4O4H10C12 AB4C4D10E12 12.69 5.27 -9.3 -1.85 1
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37140 8017352 1 OCl2N3C18H20 AB2C3D18E20 8.25 3.76 0.0 0.0 0
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37141 8017379 1 ClSN3O3H18C20 ABC3D3E18F20 -51.52 1.92 -8.95 -1.22 0
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37142 8017383 1 BrClN3O3H9C15 ABC3D3E9F15 -37.73 1.29 -9.48 -1.5 0
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37143 8017450 1 SO3N4C18H24 AB3C4D18E24 -79.94 1.78 -9.29 -0.79 0
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37144 8017456 1 Cl2O3N5H11C16 A2B3C5D11E16 -14.73 5.45 -9.57 -1.86 0
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37145 8017460 1 BrClNO4H13C15 ABCD4E13F15 -105.71 1.69 -8.61 -1.42 0
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37146 8017483 1 N2O5C18H22 A2B5C18D22 -214.23 4.81 -9.6 -0.74 0
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37147 8017495 1 ClSN3O5H12C13 ABC3D5E12F13 -180.3 1.96 -10.13 -1.54 0
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37148 8017510 1 ClN2O3C20H25 AB2C3D20E25 -135.95 4.33 -9.75 -1.61 0
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37149 8017527 1 ClNO5H12C14 ABC5D12E14 -158.42 3.01 -9.78 -1.44 0
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37150 8017564 1 ClNO5H10C16 ABC5D10E16 -140.3 5.08 -9.59 -1.6 0
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37151 8017573 1 ClF2N2O5H11C16 AB2C2D5E11F16 -255.86 4.7 -10.26 -1.36 0
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37152 8017574 1 ClNO2H12C19 ABC2D12E19 3.39 4.12 -9.11 -1.34 0