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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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25168 620538 1 OSiF5C19H29 ABC5D19E29 -351.21 4.03 -10.02 -0.78 0
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25169 620695 2 NH6C9 AB6C9 121.3 4.42 -9.08 -0.86 0
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25170 620696 2 NH6C9 AB6C9 101.23 0.82 -8.9 -1.06 0
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25171 620697 1 FO2H13C16 AB2C13D16 -59.58 3.06 -9.22 -0.88 0
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25172 620719 1 ClON2H15C17 ABC2D15E17 18.35 2.87 -9.16 -0.88 0
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25173 620724 1 ClN2H13C15 AB2C13D15 72.29 4.52 -8.27 -0.59 0
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25174 620794 1 OSiC17H38 ABC17D38 -171.87 1.85 -9.19 1.46 0
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25175 620823 1 ClSO3H21C22 ABC3D21E22 -66.31 2.62 -9.1 -0.91 -6
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25176 620824 1 NNiC14H17 ABC14D17 190.3 1.55 -7.61 -3.71 0
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25177 620825 1 NPO4C11H16 ABC4D11E16 -210.97 3.82 -8.22 0.22 0
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25178 620826 1 NSBr2H3C4 ABC2D3E4 46.44 1.06 -9.44 -1.0 0
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25179 620827 1 N2O2C23H34 A2B2C23D34 -109.19 4.67 -9.06 0.88 0
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25180 620828 1 NOSC15H15 ABCD15E15 30.08 4.41 -8.32 -0.48 0
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25181 620829 1 O2C27H46 A2B27C46 -166.79 2.85 -9.44 2.38 0
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25182 620830 1 N3O6H7C12 A3B6C7D12 -78.78 3.35 -8.42 -2.34 0
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25183 620831 1 ClN2O3F6H13C14 AB2C3D6E13F14 -426.26 5.66 -9.59 -0.77 0
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25184 620832 1 ClN2O3F6H13C14 AB2C3D6E13F14 -428.61 5.81 -9.48 -0.76 0
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25185 620833 1 NO2C16H19 AB2C16D19 -79.32 3.39 -9.05 0.09 0
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25186 620845 1 NO3C15H15 AB3C15D15 -19.07 7.0 -9.12 -1.21 -10
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25187 620852 1 FeNC14H19 ABC14D19 78.45 3.45 -7.6 1.07 0
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25188 620854 1 O6H16C17 A6B16C17 -207.38 4.23 -9.17 -1.31 0
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25189 620856 1 ClNOH12C15 ABCD12E15 13.03 4.15 -8.46 -1.3 0
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25190 620923 1 NO3C20H27 AB3C20D27 -93.98 3.06 -8.55 0.38 0
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25191 620924 1 N4O4C29H46 A4B4C29D46 -180.1 10.13 -8.05 -0.43 0
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25192 620925 1 O4C23H36 A4B23C36 -229.66 4.38 -9.88 0.4 0
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25193 620926 1 O6C17H20 A6B17C20 -201.96 5.5 -8.92 -0.81 0
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25194 620927 1 N2O4F6C15H16 A2B4C6D15E16 -473.78 4.53 -9.4 -0.69 0
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25195 620933 1 O4C21H28 A4B21C28 -189.08 4.67 -9.82 -0.05 0
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25196 620934 1 OCl2N7C25H31 AB2C7D25E31 30.24 7.98 -8.41 -0.53 0
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25197 620935 1 O2F3N6H23C24 A2B3C6D23E24 -86.7 5.98 -8.82 -1.35 0
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25198 620936 1 OC20H32 AB20C32 -72.72 2.39 -9.87 2.27 0
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25199 620937 1 ClOSN3C16H18 ABCD3E16F18 12.22 2.93 -8.68 -1.13 -3
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25200 620954 1 INNiOPC14H29 ABCDEF14G29 -70.28 9.64 -8.12 0.26 -3
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25201 620955 1 NOC8H14 ABC8D14 -24.48 4.23 0.0 0.0 0
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25202 620956 1 N2C17H26 A2B17C26 -2.96 2.16 -8.43 0.5 0
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25203 620959 2 ClON2H6C9 ABC2D6E9 10.54 7.48 -9.35 -1.05 0
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25204 620960 1 IN2H7C8 AB2C7D8 74.97 4.45 -9.08 -1.5 0
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25205 620961 1 N2O4H10C13 A2B4C10D13 -92.0 7.41 -8.15 -1.93 0
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25206 620962 1 ClN2O4H21C22 AB2C4D21E22 -104.82 2.17 -9.07 -0.77 0
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25207 620963 1 SN6H10C11 AB6C10D11 136.31 4.0 -9.22 -1.38 0
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25208 620964 1 SN2C15H18 AB2C15D18 51.97 3.85 -8.62 0.03 0
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25209 620965 1 BO5C27H31 AB5C27D31 -256.05 7.36 -9.72 -0.64 0
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25210 620966 1 S2N3H17C19 A2B3C17D19 87.98 1.36 -8.34 -0.78 0
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25211 620968 1 OB2C16H28 AB2C16D28 -162.57 1.28 -8.61 0.81 0
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25212 620969 1 ON2C16H22 AB2C16D22 4.07 3.37 -9.45 -0.22 0
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25213 620971 1 SO3H10C14 AB3C10D14 -33.91 2.29 -8.85 -1.02 0
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25214 620972 1 IN2H7C8 AB2C7D8 55.93 4.06 -9.03 -0.87 0
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25215 620973 1 BrN3O3H20C21 AB3C3D20E21 -29.29 6.86 -9.51 -0.97 0
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25216 620974 1 N3O4C22H23 A3B4C22D23 -72.38 8.84 -9.38 -0.62 0
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25217 620975 1 SN2O2C16H18 AB2C2D16E18 -27.59 5.19 -8.49 -1.12 0
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25218 620976 1 O2N3C15H19 A2B3C15D19 -70.85 2.38 -8.74 -0.34 0
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25219 620977 1 O3N4H10C12 A3B4C10D12 -41.85 2.81 -9.29 -1.21 0
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25220 620978 1 NPC18H40 ABC18D40 -69.97 2.52 -8.41 2.85 0
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25221 620980 2 OSiC6H13 ABC6D13 -204.72 1.71 -8.29 1.09 0
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25222 620982 1 ClOH15C16 ABC15D16 7.94 3.05 -8.78 -0.03 0
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25223 621055 1 NOC17H25 ABC17D25 -60.13 3.93 -8.82 0.8 0
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25224 621062 2 OH5C9 AB5C9 20.81 0.01 -8.77 -1.07 -6
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25225 621082 1 CoN2C14H18 AB2C14D18 48.31 13.76 0.0 0.0 0
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25226 621086 1 NO4C16H17 AB4C16D17 -57.12 1.62 -8.72 -0.17 0
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25227 621092 1 NSO4C18H21 ABC4D18E21 -139.34 3.51 -8.77 -1.9 0
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25228 621093 1 O2C29H48 A2B29C48 -166.15 2.26 -9.38 0.9 0
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25229 621104 1 FO3C21H31 AB3C21D31 -228.76 3.45 -9.08 0.8 0
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25230 621113 1 N4O4C25H36 A4B4C25D36 -28.09 10.8 -9.35 -1.55 0
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25231 621125 1 Si2O4C15H32 A2B4C15D32 -319.64 4.87 -10.09 0.49 0
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25232 621127 2 SiO3C13H27 AB3C13D27 -449.71 2.23 -9.6 0.74 0
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25233 621128 1 SSiH16C18 ABC16D18 44.48 2.08 -8.99 -0.38 0
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25234 621129 1 NSeH9C13 ABC9D13 86.44 2.9 -8.57 -0.62 0
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25235 621130 1 N3O3C16H19 A3B3C16D19 -117.13 3.81 -9.11 -0.43 0
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25236 621149 1 NSeH9C13 ABC9D13 72.85 1.12 -8.83 -0.68 0
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25237 621153 1 OCl2N2H12C14 AB2C2D12E14 4.9 4.07 -9.71 -1.3 -4
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25238 621159 1 OC14H14 AB14C14 34.41 2.17 -9.51 0.21 0
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25239 621160 1 SN3O3H13C18 AB3C3D13E18 57.81 4.16 -8.92 -1.92 0
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25240 621341 1 SO2C15H16 AB2C15D16 -55.5 6.94 -9.37 -0.38 0
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25241 621346 1 O2N4C13H16 A2B4C13D16 -33.96 2.32 -9.71 -0.57 0
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25242 621381 1 O5H12C14 A5B12C14 -153.65 6.58 -8.74 -1.12 0