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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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231242 87573140 1 ClO2N8C23H27 AB2C8D23E27 4.08 9.78 -9.27 -0.99 0
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231243 87573157 1 AsN2C8H15 AB2C8D15 96.95 3.01 -8.3 -0.63 0
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231244 87573160 1 SN2O2C12H16 AB2C2D12E16 -73.54 3.35 -9.05 -0.31 0
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231245 87573164 1 N2O2F6H18C27 A2B2C6D18E27 -311.81 3.36 -8.85 -1.74 1
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231246 87573173 1 NPO5C23H49 ABC5D23E49 -303.92 11.2 0.0 0.0 0
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231247 87573194 1 SO5H18C19 AB5C18D19 -161.63 8.7 -9.66 -1.39 0
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231248 87573195 1 AuCH2O2 ABC2D2 -1.9 4.17 0.0 0.0 0
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231250 87573206 1 NSi2C14H32 AB2C14D32 -44.42 2.23 0.0 0.0 0
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231251 87573209 1 ClN2O3C19H21 AB2C3D19E21 -60.87 3.76 -9.21 -0.96 0
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231252 87573210 1 SN9O13H47C49 AB9C13D47E49 -384.16 13.84 -8.42 -1.0 1
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231253 87573211 1 N2C12H15 A2B12C15 53.92 2.27 0.0 0.0 0
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231254 87573212 1 O5C8H16 A5B8C16 -252.78 1.49 -11.27 0.19 0
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231255 87573226 1 NO3C22H47 AB3C22D47 -235.25 6.91 -9.65 0.76 0
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231256 87573228 1 Si3O7C17H36 A3B7C17D36 -509.74 8.84 -9.63 -0.43 0
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231257 87573237 1 OCl2N2F6H16C18 AB2C2D6E16F18 -330.83 4.86 -9.71 -1.49 0
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231258 87573248 1 N3O3F5C29H36 A3B3C5D29E36 -366.07 1.6 -8.84 -0.35 0
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231259 87573250 1 SO8N9C50H57 AB8C9D50E57 -234.16 4.15 -8.69 -1.02 0
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231260 87573251 1 NSi2C18H36 AB2C18D36 -25.16 6.83 0.0 0.0 0
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231261 87573259 1 NSi2C17H36 AB2C17D36 4.71 2.6 0.0 0.0 0
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231262 87573260 1 ClN2O4C21H25 AB2C4D21E25 -124.73 6.5 -8.95 -0.64 0
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231263 87573266 1 ClO2N4C21H27 AB2C4D21E27 -32.79 10.58 -8.43 -0.5 0
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231264 87573277 1 SN2O4C16H22 AB2C4D16E22 -167.17 2.95 -9.18 -0.8 0
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231266 87573291 1 O6Si6C20H49 A6B6C20D49 -621.96 5.99 0.0 0.0 0
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231267 87573292 1 NO2S2C11H11 AB2C2D11E11 -44.71 2.03 -9.03 -0.76 0
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231268 87573296 1 SO3F4N4H24C25 AB3C4D4E24F25 -243.22 4.48 -9.02 -1.0 0
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231269 87573298 1 NSO4C8H17 ABC4D8E17 -196.64 3.97 -10.49 -0.4 0
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231270 87573302 1 ClN3C13H16 AB3C13D16 65.47 2.22 -8.68 -0.89 0
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231271 87573311 1 N2O5C21H38 A2B5C21D38 -282.82 3.34 -9.61 0.06 0
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231272 87573315 1 SN3O4F7H16C21 AB3C4D7E16F21 -402.95 6.75 -9.51 -1.51 0
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231273 87573318 1 PSF3O3C15H32 ABC3D3E15F32 -319.72 23.42 -9.48 0.06 0
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231274 87573323 1 N2O7C20H20 A2B7C20D20 -228.14 7.36 -11.47 -1.15 0
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231275 87573331 1 ClO3N6C22H25 AB3C6D22E25 0.5 7.35 -9.22 -1.08 0
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231276 87573336 1 SO2C16H30 AB2C16D30 -137.28 6.03 -9.44 -0.68 0
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231277 87573337 1 SO2C16H30 AB2C16D30 -134.3 4.63 -8.99 -0.41 0
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231278 87573338 1 BrClNOC12H13 ABCDE12F13 -32.95 4.35 -9.57 -0.59 0
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231279 87573341 1 SiO5C8H18 AB5C8D18 -319.19 7.25 -10.04 0.55 0
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231280 87573342 1 SN3O3F5C21H22 AB3C3D5E21F22 -328.52 3.12 -9.55 -1.09 0
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231281 87573349 1 S2O4C41H54 A2B4C41D54 -149.76 7.95 -8.14 -0.11 -1
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231282 87573354 1 CZnH2N5 ABC2D5 147.81 6.86 0.0 0.0 0
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231283 87573355 1 I3N3O9H16C17 A3B3C9D16E17 -311.08 6.97 -9.39 -1.78 0
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231284 87573359 1 O5C11H22 A5B11C22 -193.18 1.32 -10.32 -0.14 0
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231285 87573362 1 O5C11H22 A5B11C22 -261.93 2.04 -10.66 -0.33 1
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231286 87573369 1 F2O2N6C25H29 A2B2C6D25E29 -81.03 12.42 0.0 0.0 0
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231287 87573370 1 ClO2N9C27H34 AB2C9D27E34 -1.06 11.13 -9.24 -0.97 0
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231288 87573371 2 O2C11H21 A2B11C21 -272.4 6.17 -10.8 0.57 0
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231289 87573382 1 ClOF2N2H15C16 ABC2D2E15F16 -61.53 2.88 -9.29 -1.02 0
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231290 87573387 2 NH12C14 AB12C14 95.81 1.64 -7.86 -1.1 0
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231291 87573388 1 OSN3C4H11 ABC3D4E11 -21.28 2.48 -9.17 -0.3 0
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231292 87573390 1 O2C9H12 A2B9C12 -50.05 2.03 -9.36 -0.28 0
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231293 87573392 2 OC19H37 AB19C37 -234.21 2.94 -9.53 1.34 0