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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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175189 75864878 2 NO3C11H16 AB3C11D16 -269.1 4.1 -8.82 0.16 1
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175190 75864941 1 ON4C19H33 AB4C19D33 -34.94 3.08 0.0 0.0 1
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175191 75865086 1 O2N4C23H31 A2B4C23D31 -15.71 3.21 0.0 0.0 0
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175192 75865182 4 OC4H5 AB4C5 -146.2 3.27 -8.85 -0.87 0
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175193 75865244 1 N2O5C16H20 A2B5C16D20 -194.43 5.3 -9.23 -0.9 0
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175194 75865245 1 ClN2O6C17H19 AB2C6D17E19 -234.59 2.89 -9.11 -0.54 0
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175195 75865246 1 ClSN2O6C19H23 ABC2D6E19F23 -243.69 3.2 -10.11 -1.18 0
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175196 75865247 1 N3O4C19H21 A3B4C19D21 -142.89 2.62 -9.34 -1.35 0
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175197 75865248 1 N3O4C20H21 A3B4C20D21 -126.29 4.63 -9.7 -1.3 0
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175198 75865404 1 SO2N5H17C21 AB2C5D17E21 80.14 8.98 -8.98 -1.3 0
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175199 75865778 1 O4N5C23H33 A4B5C23D33 -67.27 6.2 -8.94 -1.1 0
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175200 75866216 1 ON2C19H20 AB2C19D20 21.94 3.56 -9.21 -0.38 0
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175201 75866374 1 SN3O3H21C23 AB3C3D21E23 -25.62 6.01 -9.02 -0.97 0
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175202 75866375 1 SO3N5C21H23 AB3C5D21E23 -31.47 2.81 -9.19 -0.98 0
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175203 75866376 1 SO2N5C22H33 AB2C5D22E33 -61.62 2.02 -8.76 -0.47 0
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175204 75866421 1 Cl2S2N3O3H15C16 A2B2C3D3E15F16 -37.33 8.69 -9.15 -1.95 0
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175205 75866501 1 SN3O3C24H25 AB3C3D24E25 -33.28 7.28 -9.2 -0.64 0
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175206 75866505 1 ClN2O3C21H29 AB2C3D21E29 -137.54 3.8 -8.85 -0.33 0
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175207 75866506 1 Cl2N2O3C21H22 A2B2C3D21E22 -98.99 2.71 -9.04 -0.49 0
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175208 75866831 1 SN2O3C24H28 AB2C3D24E28 -80.34 5.52 -8.9 -0.45 0
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175209 75866834 1 NSF3O4C22H24 ABC3D4E22F24 -289.76 3.95 -9.72 -1.06 0
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175210 75866903 1 SO3N5C23H35 AB3C5D23E35 -108.64 5.23 -9.02 -0.69 0
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175211 75867763 1 FOSN2H17C19 ABCD2E17F19 -28.01 0.7 -8.46 -0.46 0
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175212 75867963 1 FN3O3C23H28 AB3C3D23E28 -131.7 4.58 -8.5 -0.19 1
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175213 75868055 1 N3O5C25H34 A3B5C25D34 -144.0 4.68 0.0 0.0 0
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175214 75868056 1 N3O5C25H33 A3B5C25D33 -148.05 3.04 -8.68 -0.74 1
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175215 75868057 1 SN3O3C25H32 AB3C3D25E32 -23.44 13.14 0.0 0.0 0
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175216 75868212 4 OC5H7 AB5C7 -155.4 2.26 -8.31 0.19 0
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175217 75868227 1 O2N4C23H28 A2B4C23D28 -19.26 7.73 -7.98 -0.72 0
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175218 75868228 1 NO3C21H27 AB3C21D27 -91.14 3.23 -8.62 0.02 1
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175219 75868229 1 N4O4C20H31 A4B4C20D31 -167.53 2.64 0.0 0.0 0
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175220 75868230 1 ClSN3O3H14C18 ABC3D3E14F18 -56.41 5.06 -8.88 -0.83 -1
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175221 75868282 1 SN4O4H19C22 AB4C4D19E22 -28.67 5.6 0.0 0.0 0
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175222 75869084 1 O3N4C15H16 A3B4C15D16 -8.51 4.13 -8.89 -1.56 0
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175223 75869437 1 SCl2O2N5H11C17 AB2C2D5E11F17 36.7 8.45 -8.98 -1.27 0
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175224 75869757 1 BrOSN2C19H19 ABCD2E19F19 25.79 1.97 -8.82 -0.57 0
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175225 75869758 1 ClN4O4H15C17 AB4C4D15E17 -51.92 5.59 -9.07 -1.04 0
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175226 75869922 1 NSO2C16H19 ABC2D16E19 -41.54 3.46 -8.64 -0.56 0
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175227 75871056 1 N3O4H23C26 A3B4C23D26 -82.82 2.64 -8.71 -0.64 0
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175228 75871057 1 ClN3O4C22H22 AB3C4D22E22 -132.84 5.67 -8.6 -0.33 0
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175229 75871058 1 SN2O4H22C23 AB2C4D22E23 -60.74 3.81 -9.29 -1.12 0
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175230 75871321 2 NOC8H11 ABC8D11 -58.02 4.98 -8.53 0.24 0
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175231 75871339 1 NSO4C19H23 ABC4D19E23 -112.4 3.76 -8.59 -0.57 0
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175232 75871661 1 ClN2O6H19C21 AB2C6D19E21 -216.72 7.19 -9.03 -1.62 0
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175233 75871662 1 N4O5C26H26 A4B5C26D26 -81.77 3.25 -8.67 -1.11 0
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175234 75871663 1 O3N6C22H24 A3B6C22D24 -29.6 6.1 -8.92 -1.21 0
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175235 75871947 1 NSO2C17H21 ABC2D17E21 -44.42 3.96 -8.97 -0.27 0
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175236 75871948 1 SN2O3C18H22 AB2C3D18E22 -80.4 5.53 -8.88 -0.87 0
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175237 75871949 1 N2O4C19H24 A2B4C19D24 -120.37 3.38 -8.93 -0.33 0
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175238 75871950 1 O2N3C21H23 A2B3C21D23 2.78 2.33 -9.26 -0.58 0