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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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136212 51999609 1 N4O4C19H28 A4B4C19D28 -158.3 5.52 -9.32 0.13 0
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136213 51999786 1 O3N4C21H28 A3B4C21D28 -86.0 4.29 -8.61 0.11 0
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136214 51999787 2 N2O2C11H15 A2B2C11D15 -121.84 7.46 -8.26 0.1 0
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136215 51999788 1 O2N5C22H27 A2B5C22D27 -28.32 4.29 -8.33 0.12 0
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136216 51999951 1 OSN5C10H17 ABC5D10E17 27.84 8.57 -9.4 -0.63 0
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136217 52000011 1 OSN6C13H24 ABC6D13E24 6.83 2.3 -8.65 -0.51 0
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136218 52000012 1 OSN6C18H26 ABC6D18E26 45.23 8.2 -9.13 -0.69 0
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136219 52000656 1 O3N4C23H26 A3B4C23D26 -45.91 4.24 -8.6 0.07 0
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136220 52001023 1 O3N6C19H22 A3B6C19D22 -28.96 2.43 -9.3 -1.0 0
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136221 52001074 1 SO4N6C16H24 AB4C6D16E24 -96.2 3.54 -9.36 -0.77 0
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136222 52001472 1 N3O4C21H21 A3B4C21D21 -92.82 4.9 -8.89 -1.22 0
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136223 52002169 1 ON4C21H24 AB4C21D24 30.62 4.38 -8.28 -0.33 0
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136224 52002170 2 ON2C10H11 AB2C10D11 1.09 4.07 -8.51 -0.35 0
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136225 52002171 1 ON5H17C19 AB5C17D19 85.89 3.64 -8.61 -0.55 0
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136226 52002195 1 FON3H16C17 ABC3D16E17 -13.85 1.72 -8.78 -0.29 0
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136227 52002348 1 FON4C21H23 ABC4D21E23 -12.86 3.35 -8.66 -0.18 0
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136228 52002804 1 FON4C22H25 ABC4D22E25 -19.34 1.72 -8.76 -0.16 0
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136229 52002805 1 FON4C22H25 ABC4D22E25 -18.9 2.8 -8.8 -0.19 0
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136230 52002806 1 ClON4C22H25 ABC4D22E25 19.1 1.84 -8.78 -0.2 0
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136231 52003479 1 N3O4C21H25 A3B4C21D25 -87.92 7.04 -8.06 -0.06 0
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136232 52003480 1 O2N4C21H22 A2B4C21D22 7.52 3.22 -8.27 -0.31 0
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136233 52004048 1 O3N4C17H20 A3B4C17D20 -61.88 6.59 -9.27 -0.74 0
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136234 52004297 1 SN4O4C17H20 AB4C4D17E20 -110.69 9.03 -9.74 -0.4 0
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136235 52004462 1 FSO2N3C18H18 ABC2D3E18F18 -59.43 3.88 -8.4 -0.41 0
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136236 52004580 1 SO2N6C18H20 AB2C6D18E20 12.69 3.59 -8.45 -0.5 0
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136237 52004809 1 OSN4H18C19 ABC4D18E19 43.73 2.83 -8.71 -0.56 0
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136238 52005326 1 N4O4C17H20 A4B4C17D20 -98.33 2.69 -8.85 -0.22 0
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136239 52005342 2 ON3C7H10 AB3C7D10 -23.21 6.69 -8.34 -0.14 0
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136240 52005492 1 O3N4H20C23 A3B4C20D23 -5.84 7.99 -8.63 -1.19 0
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136241 52005796 1 O4N5C20H25 A4B5C20D25 -106.25 8.99 -9.15 -0.85 0
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136242 52006491 1 ClN3O3C13H14 AB3C3D13E14 -78.13 3.76 -8.86 -0.53 1
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136243 52006571 1 OSN4C11H19 ABC4D11E19 -1.86 5.2 0.0 0.0 0
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136244 52006572 1 OSN4C11H18 ABC4D11E18 -11.1 1.96 -8.85 -0.74 0
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136245 52006802 1 O3N4C17H22 A3B4C17D22 -73.87 4.11 -9.55 -0.04 0
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136246 52007153 1 O4N5C22H27 A4B5C22D27 -40.61 8.24 -8.59 -0.49 0
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136247 52007176 1 O4N6C19H26 A4B6C19D26 -89.02 6.72 -9.44 -0.62 0
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136248 52007375 1 ON3C15H19 AB3C15D19 -2.55 2.63 -9.37 -0.07 0
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136249 52007376 1 ON3C15H19 AB3C15D19 -3.36 3.3 -9.36 -0.08 0
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136250 52007391 1 O2N3C16H21 A2B3C16D21 -40.02 4.47 -8.96 0.01 0
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136251 52007392 1 O2N3C16H21 A2B3C16D21 -41.83 3.0 -9.04 -0.02 0
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136252 52008435 1 O3N5H15C17 A3B5C15D17 13.88 6.57 -8.61 -1.22 0
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136253 52008455 1 ON5C19H19 AB5C19D19 70.34 7.75 -9.56 -1.05 0
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136254 52008472 1 O2N5C17H17 A2B5C17D17 37.68 4.08 -9.73 -1.05 0
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136255 52008917 1 SN2O3C16H16 AB2C3D16E16 -80.81 4.61 -8.99 -0.85 0
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136256 52008918 1 SN2O3C17H18 AB2C3D17E18 -89.51 4.66 -8.85 -0.85 0
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136257 52008919 1 SN2O3C17H18 AB2C3D17E18 -89.84 5.16 -8.84 -0.65 0
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136258 52008920 2 NOSC8H8 ABCD8E8 -42.3 4.13 -8.89 -0.69 0
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136259 52008928 1 SO2N3C22H25 AB2C3D22E25 -45.27 5.28 -8.66 -0.78 0
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136260 52008939 1 ClSO2N3C21H22 ABC2D3E21F22 -43.96 4.96 -8.81 -0.79 0
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136261 52009071 1 SN2O2C14H18 AB2C2D14E18 -75.41 4.66 -8.76 -0.62 0
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136262 52009072 1 SN2O2C14H16 AB2C2D14E16 -46.68 4.02 -8.76 -0.61 0
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136263 52009255 1 SN3O3C19H19 AB3C3D19E19 -89.21 5.98 -8.32 -0.67 0
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136264 52009256 1 SN3O3C19H19 AB3C3D19E19 -86.39 6.37 -8.43 -0.7 0
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136265 52009257 1 SN2O2C19H20 AB2C2D19E20 -45.92 4.94 -8.78 -0.68 0
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136266 52009369 1 SO2N5C19H21 AB2C5D19E21 -11.26 3.04 -8.79 -0.66 0
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136267 52010012 1 N2O4C19H20 A2B4C19D20 -116.7 6.06 -8.86 -0.43 0
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136268 52010034 1 FN3O3C21H22 AB3C3D21E22 -112.66 5.0 -8.95 -0.48 0
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136269 52010035 1 FN3O3C21H22 AB3C3D21E22 -112.62 5.27 -8.88 -0.61 0
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136270 52010036 1 FN3O3C21H22 AB3C3D21E22 -113.87 4.02 -8.98 -0.5 0
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136271 52010037 1 FN3O3C21H22 AB3C3D21E22 -114.12 6.13 -8.96 -0.66 0
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136272 52010180 1 O2N5C16H21 A2B5C16D21 -0.08 7.65 -9.59 -1.11 0
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136273 52010249 1 O2N5C19H21 A2B5C19D21 32.25 5.58 -8.83 -1.08 0
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136274 52010417 2 ON3C11H13 AB3C11D13 32.36 6.25 -9.08 -1.25 0
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136275 52010435 1 ON6C17H18 AB6C17D18 79.41 8.32 -10.02 -1.01 0
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136276 52010436 1 OSN5C16H17 ABC5D16E17 75.02 8.75 -9.52 -1.01 0
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136277 52010642 1 SN2O3C18H20 AB2C3D18E20 -69.38 3.44 -8.7 -0.34 0
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136278 52010643 1 SN2O3C18H20 AB2C3D18E20 -65.69 4.47 -8.68 -0.33 0
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136279 52011287 1 N2O5C20H20 A2B5C20D20 -160.73 3.42 -8.82 -0.64 0
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136280 52011385 1 N2O4C21H24 A2B4C21D24 -125.99 4.66 -8.54 -0.24 0
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136281 52011539 2 NO2C10H11 AB2C10D11 -121.14 4.08 -8.69 -0.4 0
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136282 52011699 1 ON5C21H21 AB5C21D21 63.9 4.57 -8.33 -0.36 0
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136283 52012399 1 ON2S2C13H16 AB2C2D13E16 -7.07 2.16 -8.51 -0.48 0
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136284 52012587 1 SN2O3C18H18 AB2C3D18E18 -67.96 4.86 -8.68 -0.9 0
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136285 52012627 1 FOSN2C17H17 ABCD2E17F17 -32.78 2.81 -8.46 -0.44 0
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136286 52012628 1 SN2O2C18H20 AB2C2D18E20 -25.71 2.75 -8.41 -0.4 0
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136287 52012629 1 SN2O3C18H18 AB2C3D18E18 -48.08 2.5 -8.41 -0.37 0
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136288 52013054 1 SN2O2H20C23 AB2C2D20E23 10.68 5.37 -8.65 -0.72 0
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136289 52013113 1 OSN2C27H28 ABC2D27E28 36.12 2.82 -8.4 -0.29 0
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136290 52013114 1 SO2N3C21H23 AB2C3D21E23 -26.41 6.01 -8.38 -0.37 0
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136291 52013115 1 SN2O2C19H20 AB2C2D19E20 -12.96 2.59 -8.52 -0.43 0
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136292 52013116 1 SN2O2C21H24 AB2C2D21E24 -28.12 2.41 -8.49 -0.47 0
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136293 52013216 1 OSN4C24H24 ABC4D24E24 64.96 2.38 -8.47 -0.42 0
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136294 52013260 1 OSN2C15H20 ABC2D15E20 -21.04 0.33 -8.4 -0.38 0
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136295 52013261 1 OSN2C15H18 ABC2D15E18 7.06 1.87 -8.42 -0.4 0
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136296 52013262 1 OSN2C16H22 ABC2D16E22 -26.45 2.47 -8.37 -0.31 0
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136297 52013263 1 OSN2C17H24 ABC2D17E24 -32.26 0.94 -8.37 -0.33 0
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136298 52013372 1 ClOSN2C20H21 ABCD2E20F21 -0.66 1.99 -8.43 -0.43 0
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136299 52013608 1 FN2O4H17C22 AB2C4D17E22 -102.34 3.02 -9.1 -1.06 0
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136300 52014301 1 N2O3H18C19 A2B3C18D19 -58.17 6.71 -8.5 -0.7 0
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136301 52014552 1 ClON2C19H19 ABC2D19E19 7.84 3.59 -8.65 -0.52 0
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136302 52014658 1 ClON4H19C21 ABC4D19E21 50.33 3.61 -8.64 -0.74 0
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136303 52014918 1 FON2H19C20 ABC2D19E20 -40.85 3.13 -8.81 -0.64 0
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136304 52015343 1 FN3O3C21H22 AB3C3D21E22 -122.44 3.53 -8.87 -0.5 0
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136305 52015443 1 ClN2O3C19H19 AB2C3D19E19 -103.49 5.11 -9.07 -0.65 0
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136306 52015653 1 N3O4H15C22 A3B4C15D22 -18.27 4.49 -9.24 -1.26 0
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136307 52015654 1 N2O5H20C23 A2B5C20D23 -96.06 6.97 -8.64 -1.24 0
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136308 52015655 1 NO5H15C20 AB5C15D20 -96.64 5.03 -8.9 -1.2 0
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136309 52015656 1 NO5H17C25 AB5C17D25 -67.44 6.28 -8.86 -1.24 0
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136310 52017194 1 SO3N6C24H30 AB3C6D24E30 -47.88 6.38 -8.48 -0.93 0
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136311 52017697 1 SN2O4C20H20 AB2C4D20E20 -129.0 4.43 -8.86 -0.69 0