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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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42104 8149191 1 OS2N3C18H22 AB2C3D18E22 21.5 12.82 0.0 0.0 0
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42105 8149192 1 OS2N3C18H21 AB2C3D18E21 9.22 4.27 -8.62 -0.97 0
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42106 8149193 1 SN3O3H17C18 AB3C3D17E18 -64.41 3.1 -8.84 -1.28 0
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42107 8149194 1 SN3O3C21H23 AB3C3D21E23 -94.25 4.2 -8.71 -0.99 0
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42108 8149196 1 SN3O3C21H23 AB3C3D21E23 -94.51 3.82 -8.75 -1.04 0
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42109 8149197 1 SN3O3C21H23 AB3C3D21E23 -93.36 4.0 -8.75 -1.04 0
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42110 8149199 1 SN3O5C20H21 AB3C5D20E21 -173.96 4.17 -9.24 -1.58 0
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42111 8149201 1 S2N3O3H17C20 A2B3C3D17E20 -36.49 3.6 -8.87 -1.36 0
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42112 8149202 1 SN3O3C21H25 AB3C3D21E25 -97.69 2.66 -8.93 -1.23 0
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42113 8149203 1 SN3O3C21H25 AB3C3D21E25 -97.6 3.51 -8.78 -1.01 1
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42114 8149204 1 SN3O5C16H22 AB3C5D16E22 -166.55 9.08 0.0 0.0 0
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42115 8149205 1 SN3O5C16H21 AB3C5D16E21 -183.06 4.19 -9.14 -1.42 1
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42116 8149206 1 SO2N3C17H24 AB2C3D17E24 -56.83 5.06 0.0 0.0 0
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42117 8149207 1 SO2N3C17H23 AB2C3D17E23 -74.08 1.83 -8.64 -0.89 2
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42118 8149208 1 SN2O3C15H24 AB2C3D15E24 -97.86 5.87 -9.38 0.04 0
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42119 8149209 1 SN2O3C15H22 AB2C3D15E22 -106.1 4.94 -8.81 0.2 1
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42120 8149210 1 SO2N3C17H24 AB2C3D17E24 -55.6 5.06 0.0 0.0 0
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42121 8149211 1 SO2N3C17H23 AB2C3D17E23 -72.92 1.72 -8.63 -0.89 1
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42122 8149212 1 SO2N3C17H24 AB2C3D17E24 -56.84 4.98 0.0 0.0 0
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42123 8149213 1 SO2N3C17H23 AB2C3D17E23 -73.94 1.64 -8.67 -0.93 0
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42124 8149215 1 SN2O3C15H22 AB2C3D15E22 -101.6 4.96 -9.06 0.2 1
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42125 8149216 1 SO2N3C17H24 AB2C3D17E24 -55.64 5.08 0.0 0.0 0
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42126 8149217 1 SO2N3C17H23 AB2C3D17E23 -72.79 1.79 -8.65 -0.92 2
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42127 8149218 1 SN2O3C15H24 AB2C3D15E24 -27.42 7.38 -7.55 -0.16 0
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42128 8149219 1 SN2O3C15H22 AB2C3D15E22 -100.02 4.19 -8.57 0.31 1
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42129 8149220 1 SN3O4C16H22 AB3C4D16E22 -139.74 16.04 0.0 0.0 0
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42130 8149221 1 SN3O4C16H21 AB3C4D16E21 -154.72 4.73 -9.06 -1.34 2
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42131 8149222 1 SN2O3C15H24 AB2C3D15E24 -24.68 5.28 -5.8 -0.11 0
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42132 8149223 1 SN2O3C15H22 AB2C3D15E22 -101.75 4.1 -8.95 0.28 1
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42133 8149224 1 SN3O4C16H22 AB3C4D16E22 -139.58 16.36 0.0 0.0 0
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42134 8149225 1 SN3O4C16H21 AB3C4D16E21 -154.75 4.59 -9.05 -1.34 1
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42135 8149226 1 O2S2N3C16H18 A2B2C3D16E18 -0.73 6.88 0.0 0.0 0
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42136 8149227 1 O2S2N3C16H17 A2B2C3D16E17 -17.29 2.83 -8.72 -1.09 1
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42137 8149228 1 O2S2N3C16H18 A2B2C3D16E18 -0.74 6.93 0.0 0.0 0
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42138 8149229 1 O2S2N3C16H17 A2B2C3D16E17 -17.32 2.81 -8.7 -1.1 1
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42139 8149230 1 SO2N3C17H26 AB2C3D17E26 -64.34 4.99 0.0 0.0 0
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42140 8149231 1 SO2N3C17H25 AB2C3D17E25 -81.34 1.7 -8.7 -0.89 1
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42141 8149232 1 SO2N3C17H26 AB2C3D17E26 -64.21 4.87 0.0 0.0 0
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42142 8149233 1 SO2N3C17H25 AB2C3D17E25 -81.21 1.68 -8.7 -0.89 1
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42143 8149234 1 SO2N4C19H27 AB2C4D19E27 -62.94 7.24 0.0 0.0 0
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42144 8149235 1 SO2N4C19H26 AB2C4D19E26 -80.58 4.56 -8.66 -0.93 1
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42145 8149236 1 SO2N4C19H27 AB2C4D19E27 -61.74 7.26 0.0 0.0 0
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42146 8149237 1 SO2N4C19H26 AB2C4D19E26 -79.41 4.5 -8.66 -0.93 0
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42147 8149239 1 SO2N4C19H26 AB2C4D19E26 -80.95 2.85 -8.74 -1.0 0
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42148 8149241 1 SO2N4C19H26 AB2C4D19E26 -79.91 2.74 -8.71 -0.98 1
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42149 8149242 1 O2S2N4C18H21 A2B2C4D18E21 -7.49 4.5 0.0 0.0 0
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42150 8149243 2 OSN2C9H10 ABC2D9E10 -23.84 5.85 -8.73 -1.12 1
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42151 8149244 1 O2S2N4C18H21 A2B2C4D18E21 -6.71 8.99 0.0 0.0 1
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42152 8149246 1 SO2N4C19H29 AB2C4D19E29 -70.56 3.58 0.0 0.0 0
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42153 8149247 1 SO2N4C19H28 AB2C4D19E28 -87.8 4.41 -8.71 -0.92 1
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42154 8149248 1 SO2N4C19H29 AB2C4D19E29 -69.82 6.97 0.0 0.0 0
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42155 8149249 1 SO2N4C19H28 AB2C4D19E28 -87.73 2.96 -8.8 -1.0 1
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42156 8149250 1 SO2N4C21H25 AB2C4D21E25 -25.96 6.61 0.0 0.0 0
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42157 8149251 1 SO2N4C21H24 AB2C4D21E24 -43.1 4.03 -8.79 -0.91 1
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42158 8149252 1 SO2N4C23H29 AB2C4D23E29 -29.83 6.15 0.0 0.0 0
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42159 8149253 1 SO2N4C23H28 AB2C4D23E28 -44.97 2.53 -8.56 -0.86 1
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42160 8149254 1 SO2N4C23H29 AB2C4D23E29 -28.65 6.06 0.0 0.0 0
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42161 8149255 1 SO2N4C23H28 AB2C4D23E28 -43.33 2.2 -8.6 -0.84 1
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42162 8149256 1 SO2N4C23H29 AB2C4D23E29 -30.09 4.98 0.0 0.0 0
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42163 8149257 1 SO2N4C23H28 AB2C4D23E28 -44.89 1.77 -8.63 -0.88 1
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42164 8149258 1 SO2N4C23H29 AB2C4D23E29 -29.26 5.76 0.0 0.0 0
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42165 8149259 1 SO2N4C23H28 AB2C4D23E28 -43.83 1.86 -8.61 -0.86 1
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42166 8149260 1 SO2N4C23H31 AB2C4D23E31 -34.85 4.36 0.0 0.0 0
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42167 8149261 1 SO2N4C23H30 AB2C4D23E30 -54.42 2.69 -8.28 -0.87 1
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42168 8149262 1 OSN4C21H25 ABC4D21E25 54.59 6.77 0.0 0.0 1
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42169 8149263 1 SO2N4C23H31 AB2C4D23E31 -38.09 6.14 0.0 0.0 0
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42170 8149264 1 SO2N4C23H30 AB2C4D23E30 -52.39 3.07 -8.69 -0.87 0
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42171 8149265 1 SO3N4C13H14 AB3C4D13E14 -62.44 5.72 -8.87 -0.86 0
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42172 8149266 1 OSN3C20H23 ABC3D20E23 -3.01 2.8 -8.52 -0.86 0
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42173 8149267 1 SN3O3C22H27 AB3C3D22E27 -111.56 3.33 -8.59 -1.41 0
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42174 8149268 1 SO3N4C13H14 AB3C4D13E14 -64.87 4.12 -8.99 -0.96 0
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42175 8149269 1 SN3O3C22H27 AB3C3D22E27 -112.84 5.62 -8.75 -1.27 0
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42176 8149270 1 OS2N3C22H23 AB2C3D22E23 26.13 3.82 -8.67 -1.04 0
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42177 8149271 1 OS2N3C22H23 AB2C3D22E23 24.77 4.22 -8.62 -1.0 0
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42178 8149273 1 SO2N4C20H28 AB2C4D20E28 -85.53 4.52 -8.65 -0.92 1