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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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175113 75856954 1 O2N3C20H27 A2B3C20D27 -55.41 2.09 -8.73 -0.26 0
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175114 75857009 1 ClFO2N5C21H25 ABC2D5E21F25 -86.94 8.24 -8.52 -0.19 0
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175115 75857282 1 SF3N4O4H13C14 AB3C4D4E13F14 -200.74 3.6 -9.78 -3.32 0
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175116 75857550 1 FNO2C18H20 ABC2D18E20 -91.54 2.9 -8.35 -0.21 0
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175117 75857551 1 FNO2C18H20 ABC2D18E20 -91.55 0.21 -8.22 -0.35 0
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175118 75858570 1 SN4O4C15H18 AB4C4D15E18 -0.37 4.91 -9.09 -1.48 1
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175119 75858752 1 N3O4C15H20 A3B4C15D20 -80.6 8.54 0.0 0.0 1
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175120 75858855 1 ClNOC13H19 ABCD13E19 -18.3 6.29 0.0 0.0 0
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175121 75858856 1 ClNOC13H18 ABCD13E18 -38.18 1.62 -8.59 -0.03 1
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175122 75858857 1 SN3O3C22H32 AB3C3D22E32 -69.33 3.22 0.0 0.0 1
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175123 75859062 1 O3N5C20H30 A3B5C20D30 -69.78 4.91 0.0 0.0 0
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175124 75859063 1 N2S2O3C21H32 A2B2C3D21E32 -134.83 8.58 -8.94 -0.44 1
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175125 75859064 1 N2O5C24H29 A2B5C24D29 -136.62 4.12 0.0 0.0 0
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175126 75859065 1 N2O5C24H28 A2B5C24D28 -153.64 4.44 -7.98 -0.13 1
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175127 75859066 1 ClSN3O3C18H23 ABC3D3E18F23 -53.13 3.14 0.0 0.0 1
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175128 75859067 1 ClSO2N5C17H25 ABC2D5E17F25 -26.16 1.84 0.0 0.0 0
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175129 75859068 1 O3N4C27H28 A3B4C27D28 -52.61 4.74 -8.88 -0.84 1
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175130 75859069 3 ON2C8H9 AB2C8D9 -44.53 5.74 0.0 0.0 1
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175131 75859070 1 N3O3C19H24 A3B3C19D24 -51.34 2.29 0.0 0.0 1
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175132 75859071 1 N2O4C23H31 A2B4C23D31 -101.5 4.95 0.0 0.0 1
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175133 75859270 1 OSN3C21H32 ABC3D21E32 -26.76 11.04 0.0 0.0 0
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175134 75859271 1 OSN3C21H31 ABC3D21E31 -35.82 4.06 -8.54 -0.06 0
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175135 75859272 1 O3N5C26H43 A3B5C26D43 -159.83 6.48 -9.16 0.04 0
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175136 75859463 1 O2F3N4C24H27 A2B3C4D24E27 -205.77 4.88 -8.6 -0.61 1
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175137 75859623 1 N4O4C23H27 A4B4C23D27 -50.28 4.99 0.0 0.0 1