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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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166142 74642694 1 O3N4C23H27 A3B4C23D27 -80.03 4.46 0.0 0.0 0
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166143 74642695 1 O3N6C27H40 A3B6C27D40 -110.09 6.4 -8.02 -0.26 0
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166144 74642696 1 SO2N3C25H27 AB2C3D25E27 3.57 5.91 -7.97 -0.58 0
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166145 74642697 1 ClN2O4C21H23 AB2C4D21E23 -143.11 4.49 -9.81 -0.76 0
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166146 74642698 1 F2N2O2C21H22 A2B2C2D21E22 -132.69 4.68 -8.12 -0.87 0
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166147 74642699 1 SN3O3C23H27 AB3C3D23E27 -68.26 6.14 -8.04 -0.28 0
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166148 74642700 1 FNO4H18C19 ABC4D18E19 -149.8 2.97 -9.06 -0.78 0
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166149 74642701 2 NO2C10H10 AB2C10D10 -117.68 4.42 -8.93 -0.69 0
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166150 74642702 1 FSN3O3C24H26 ABC3D3E24F26 -95.9 4.47 -8.09 -0.96 0
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166151 74642703 1 N3O5C23H33 A3B5C23D33 -226.45 4.36 -8.07 -0.01 0
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166152 74642704 1 SN2O4C20H24 AB2C4D20E24 -108.21 6.05 -8.95 -0.58 0
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166153 74642705 1 N2O5C25H32 A2B5C25D32 -171.12 5.94 -7.78 -0.77 0
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166154 74642706 1 SO4N5C25H25 AB4C5D25E25 -45.89 12.33 -8.64 -1.5 0
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166155 74642707 1 SN2O5C23H30 AB2C5D23E30 -157.83 7.02 -8.08 -0.92 0
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166156 74642726 1 N2O2C21H24 A2B2C21D24 -27.4 3.94 -8.08 -0.48 0
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166157 74642727 1 N2O3C22H26 A2B3C22D26 -69.94 6.08 -7.97 -0.32 0
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166158 74642728 1 SN3O3F5H14C17 AB3C3D5E14F17 -251.99 7.34 -9.88 -1.66 0
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166159 74642891 1 ClSO2N5C24H24 ABC2D5E24F24 33.58 6.47 -8.3 -1.14 0
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166160 74643395 1 S2N5C15H21 A2B5C15D21 38.51 6.03 -8.62 -0.58 1
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166161 74643396 1 S2N5C16H16 A2B5C16D16 88.87 2.12 0.0 0.0 1
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166162 74644131 1 SO2N3H16C18 AB2C3D16E18 44.78 1.98 0.0 0.0 1
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166163 74644132 1 ClSO2N3H17C20 ABC2D3E17F20 51.87 1.27 0.0 0.0 1
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166164 74644179 1 ClSO2N4C21H22 ABC2D4E21F22 5.72 3.83 0.0 0.0 1
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166165 74644180 1 SO2Cl3N4H16C20 AB2C3D4E16F20 22.17 5.71 0.0 0.0 1
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166166 74644181 1 ClSO2N4C22H24 ABC2D4E22F24 -0.31 3.47 0.0 0.0 1
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166167 74644229 1 NO2C21H28 AB2C21D28 -9.94 2.7 0.0 0.0 0
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166168 74644230 1 NO2C21H27 AB2C21D27 -30.83 2.04 -8.1 0.03 0
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166169 74644733 2 N2O2C7H8 A2B2C7D8 -95.39 7.08 -9.42 -1.33 0
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166170 74644734 1 N4O5H22C25 A4B5C22D25 -75.6 7.18 -8.56 -1.44 0
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166171 74644833 2 ON2C6H11 AB2C6D11 -95.93 2.46 -9.44 0.65 0
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166172 74644834 1 O2N4C9H18 A2B4C9D18 -88.61 2.68 -9.74 0.63 0
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166173 74645189 1 BrNSO3C14H20 ABCD3E14F20 -103.86 6.2 -9.24 -0.85 0
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166174 74645190 1 NSO3C15H23 ABC3D15E23 -121.56 5.56 -9.02 -0.55 1
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166175 74645386 1 ClNO4C21H25 ABC4D21E25 -106.27 1.86 0.0 0.0 0
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166176 74645550 1 N2O7C22H22 A2B7C22D22 -154.19 5.88 -8.37 -0.91 -1
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166177 74645559 1 ClSN4O4H14C22 ABC4D4E14F22 -4.2 4.29 0.0 0.0 0
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166178 74645841 1 O3N4C15H18 A3B4C15D18 -74.67 5.95 -9.41 -0.07 0
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166179 74646310 1 SN4O5C20H26 AB4C5D20E26 -168.47 6.65 -8.66 -0.42 1
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166180 74646642 1 FON5C20H23 ABC5D20E23 27.32 5.77 0.0 0.0 1
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166181 74646643 1 N2O4C22H29 A2B4C22D29 -100.01 3.65 0.0 0.0 0
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166182 74646874 1 O3N4C18H22 A3B4C18D22 -25.2 3.83 -8.75 -1.44 1
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166183 74646875 1 N3O4C26H34 A3B4C26D34 -100.16 1.95 0.0 0.0 0
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166184 74647085 1 FO2N4H15C17 AB2C4D15E17 -25.74 5.85 -8.79 -1.92 0
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166185 74647622 1 O3N5C23H27 A3B5C23D27 -6.71 12.35 -8.65 -2.31 0
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166186 74648351 1 NO5C19H21 AB5C19D21 -149.07 4.37 -8.5 -0.61 0
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166187 74648440 1 SO2N4H18C24 AB2C4D18E24 71.93 7.87 -9.13 -1.94 0
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166188 74648747 1 OSN3C18H21 ABC3D18E21 26.52 4.34 -8.87 -0.43 0
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166189 74649057 1 O3N4C20H26 A3B4C20D26 -86.55 7.7 -8.86 0.09 0
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166190 74649058 1 SN4O5C21H30 AB4C5D21E30 -141.76 3.68 -8.69 -0.78 0
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166191 74649131 1 ClF2N4O4C17H19 AB2C4D4E17F19 -265.14 6.04 -9.26 -0.78 0