List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
373192 131311315 1 BrSO4H7C10 ABC4D7E10 -124.57 6.98 -9.55 -1.25 0
373193 131311320 1 BrSO4H7C10 ABC4D7E10 -125.86 5.0 -9.11 -1.37 0
373194 131311342 1 BrSO2C12H13 ABC2D12E13 -50.32 1.41 -8.27 -0.49 0
373195 131311343 1 BrSO2C12H13 ABC2D12E13 -47.64 3.35 -8.01 -0.65 0
373196 131311356 2 FOSH4C5 ABCD4E5 -144.16 3.33 -8.64 -1.0 0
373197 131311383 1 ON2C11H12 AB2C11D12 1.75 4.66 -8.64 -0.07 0
373198 131311392 2 N2C5H6 A2B5C6 59.59 2.76 -8.82 -0.84 0
373199 131311418 1 BrFSO2H6C10 ABCD2E6F10 -89.87 3.96 -9.22 -1.42 0
373200 131311441 1 SO2C12H12 AB2C12D12 -49.61 5.14 -9.04 -1.15 0
373201 131311442 1 SO2C12H12 AB2C12D12 -47.36 3.86 -8.9 -0.99 0
373202 131311452 1 NSO3H9C11 ABC3D9E11 -5.77 8.82 -9.56 -1.46 0
373203 131311463 1 BrClNO2C9H11 ABCD2E9F11 -77.84 0.58 -9.73 -0.69 0
373204 131311490 1 BrClF2O2H8C9 ABC2D2E8F9 -175.17 4.69 -9.47 -0.74 0
373205 131311516 1 BrF2O2H7C8 AB2C2D7E8 -172.61 3.15 -9.69 -0.83 0
373206 131311581 1 FO3H11C12 AB3C11D12 -158.56 4.0 -10.12 -1.01 0
373207 131311590 1 ON2H10C11 AB2C10D11 3.01 2.16 -9.12 -0.73 0
373208 131311608 1 BrClN2H4C7 ABC2D4E7 55.76 2.04 -10.12 -1.52 0
373209 131311631 1 ClF2N2O3H5C7 AB2C2D3E5F7 -136.34 6.49 -9.46 -1.69 0
373210 131311633 1 BrClOF2H8C9 ABCD2E8F9 -146.92 2.53 -9.53 -0.98 0
373211 131311647 1 BrClOF2H8C9 ABCD2E8F9 -147.37 1.27 -9.58 -0.91 0
373212 131311661 1 BrClOF2H8C9 ABCD2E8F9 -147.52 1.63 -9.61 -0.85 0
373213 131311690 1 NO3H9C10 AB3C9D10 -58.64 6.69 -9.33 -1.33 0
373214 131311703 1 BrSO2C11H11 ABC2D11E11 -29.01 2.28 -8.09 -0.58 0
373215 131311705 1 BrSO2C11H11 ABC2D11E11 -30.14 2.11 -8.25 -0.76 0
373216 131311709 1 ClN2O2F3H6C7 AB2C2D3E6F7 -228.17 3.12 -9.03 -0.85 0
373217 131311731 1 ClNO2C10H12 ABC2D10E12 -75.7 3.22 -8.66 -0.26 0
373218 131311753 1 BrNOF3C9H9 ABCD3E9F9 -191.18 1.6 -9.92 -1.17 0
373219 131311759 1 BrNOF3C9H9 ABCD3E9F9 -195.07 3.61 -9.66 -1.07 0
373220 131311783 1 FN2O3H5C8 AB2C3D5E8 -39.12 3.56 -11.22 -2.09 0
373221 131311818 1 ClON2H9C10 ABC2D9E10 4.51 3.02 -9.92 -1.18 0
373222 131311839 1 NOSC10H13 ABCD10E13 -10.54 4.86 -9.26 -1.11 0
373223 131311844 1 IO2C11H15 AB2C11D15 -55.22 3.57 -8.79 -0.72 0
373224 131311872 1 FIO2C9H10 ABC2D9E10 -89.06 4.93 -8.62 -0.9 0
373225 131311876 1 FIO2C10H10 ABC2D10E10 -92.06 2.88 -9.21 -1.11 0
373226 131311892 1 IO3C10H11 AB3C10D11 -99.46 8.4 -9.56 -1.16 0
373227 131311893 1 IO3C10H11 AB3C10D11 -92.48 7.9 -9.47 -1.19 0
373228 131311914 1 IO2C10H11 AB2C10D11 -42.63 5.28 -9.04 -0.98 0
373229 131311962 1 INO2C10H10 ABC2D10E10 4.2 0.91 -9.1 -1.01 0
373230 131311980 1 ClNO3H6C8 ABC3D6E8 -20.48 7.99 -10.22 -1.44 0
373231 131311988 1 SN2C9H16 AB2C9D16 9.55 5.37 -8.48 0.83 0
373232 131311990 1 SN2C9H16 AB2C9D16 5.78 2.24 -8.56 0.8 0
373233 131311999 1 BrClOSC8H8 ABCDE8F8 -17.01 3.5 -8.6 -0.59 0
373234 131312018 2 NOC5H5 ABC5D5 -45.1 8.42 -9.87 -1.06 0
373235 131312022 1 NO2H9C10 AB2C9D10 -28.65 0.77 -9.8 -1.5 0
373236 131312038 2 NC7H12 AB7C12 -13.35 3.12 -9.3 0.05 0
373237 131312059 1 SN2O3C9H10 AB2C3D9E10 -72.26 4.19 -9.37 -0.42 0
373238 131312064 1 ON2C9H16 AB2C9D16 -31.81 4.51 -8.97 1.05 0
373239 131312089 1 BrClO2C10H10 ABC2D10E10 -76.06 4.88 -9.76 -0.91 0
373240 131312104 1 BrSN2O2H7C9 ABC2D2E7F9 -15.3 1.48 -9.55 -1.56 0
373241 131312120 1 NOSC13H13 ABCD13E13 18.85 4.81 -8.7 -1.45 0
373242 131312149 1 IN2C8H11 AB2C8D11 45.59 3.77 -8.71 -0.54 0
373243 131312150 1 ClINSF3H4O4C7 ABCDE3F4G4H7 -262.12 6.39 -9.88 -2.02 0
373244 131312162 1 ClFNOH5C9 ABCDE5F9 -31.3 2.26 -10.11 -1.54 0
373245 131312165 1 ON2C12H22 AB2C12D22 -56.92 2.35 -8.96 0.44 0
373246 131312178 1 ClOF3N3H5C8 ABC3D3E5F8 -147.61 4.15 -9.69 -1.49 0
373247 131312221 1 BFIO2C12H15 ABCD2E12F15 -182.14 4.1 -9.24 -0.74 0
373248 131312226 1 BrClO2C11H12 ABC2D11E12 -73.77 1.52 -9.01 -1.1 0
373249 131312237 1 Cl2O2C11H12 A2B2C11D12 -84.25 2.28 -9.51 -0.68 0
373250 131312246 1 BrClO2C11H12 ABC2D11E12 -75.57 4.35 -9.26 -0.76 0
373251 131312254 1 NO2C13H21 AB2C13D21 -106.31 5.42 -9.07 0.1 0
373252 131312261 1 BrNO3C10H10 ABC3D10E10 -108.77 5.67 -9.34 -1.05 0
373253 131312270 1 SN3C11H11 AB3C11D11 72.12 4.29 -9.07 -0.9 0
373254 131312273 1 SN3C11H11 AB3C11D11 60.0 5.36 -8.98 -0.65 0
373255 131312285 1 ClSN2C9H9 ABC2D9E9 46.75 0.57 -9.0 -0.78 0
373256 131312294 1 ClOSF2H5C10 ABCD2E5F10 -99.82 4.21 -9.3 -1.83 0
373257 131312297 1 ClOSF2H5C10 ABCD2E5F10 -98.82 4.43 -9.27 -1.6 0
373258 131312304 1 ClN4H9C10 AB4C9D10 73.21 6.45 -9.23 -1.43 0
373259 131312307 1 O2N3C11H19 A2B3C11D19 -86.31 4.11 -9.56 0.61 0
373260 131312312 1 FNO2C12H14 ABC2D12E14 -95.29 4.6 -9.08 -0.16 0
373261 131312322 1 SO4H10C11 AB4C10D11 -130.65 2.27 -8.75 -1.2 0
373262 131312411 1 FSO3H9C11 ABC3D9E11 -136.25 0.53 -9.33 -1.17 0
373263 131312429 1 ON2C11H12 AB2C11D12 -2.18 2.36 -8.68 0.04 0
373264 131312430 1 ON2C11H12 AB2C11D12 6.48 3.16 -8.59 0.21 0
373265 131312431 1 ON2C11H12 AB2C11D12 11.55 4.29 -8.19 0.04 0
373266 131312432 1 ON2C11H12 AB2C11D12 5.05 3.79 -8.63 0.11 0
373267 131312437 1 ON2C11H12 AB2C11D12 5.7 6.14 -9.11 -0.42 0
373268 131312448 1 ClOSF2H5C10 ABCD2E5F10 -96.29 2.33 -9.29 -1.67 0
373269 131312459 1 BN2O5C9H17 AB2C5D9E17 -298.16 9.05 -9.72 0.27 0
373270 131312467 1 ClNO2F3H5C9 ABC2D3E5F9 -196.99 3.56 -9.95 -1.45 0
373271 131312476 1 NOF2C12H15 ABC2D12E15 -135.8 4.02 -9.13 -0.3 0
373272 131312477 1 NOF2C11H13 ABC2D11E13 -130.17 4.15 -9.14 -0.5 0
373273 131312478 1 NOF2C11H13 ABC2D11E13 -111.64 3.99 -9.34 -0.45 0
373274 131312489 1 IO2C11H11 AB2C11D11 -50.48 4.97 -8.98 -0.85 0
373275 131312495 1 ClNF2C11H14 ABC2D11E14 -106.48 2.51 -9.58 -0.54 0
373276 131312592 1 ClISO2H6C10 ABCD2E6F10 -35.97 6.02 -9.32 -1.7 0
373277 131312594 1 ClISO2H8C11 ABCD2E8F11 -41.22 3.19 -9.0 -1.27 0
373278 131312611 1 ON2H12C13 AB2C12D13 19.65 6.13 -8.86 -0.68 0
373279 131312639 1 NSO3H9C11 ABC3D9E11 -7.92 4.71 -9.21 -1.81 0
373280 131312650 1 ClSO3H7C11 ABC3D7E11 -72.1 4.96 -9.2 -1.61 0
373281 131312651 1 ClSO3H7C11 ABC3D7E11 -71.71 3.35 -9.2 -1.56 0
373282 131312678 1 BrNO2C12H14 ABC2D12E14 -65.01 5.72 -9.42 -1.0 0
373283 131312681 1 SN3C12H15 AB3C12D15 51.28 2.36 -8.4 -0.2 0
373284 131312682 1 SN3C12H15 AB3C12D15 49.45 0.62 -8.55 -0.04 0
373285 131312686 1 BrN2C12H13 AB2C12D13 51.52 2.59 -8.91 -0.43 0
373286 131312689 1 BrN3H10C11 AB3C10D11 67.23 3.84 -9.03 -0.64 0
373287 131312705 1 FN2C12H15 AB2C12D15 -25.46 4.56 -8.72 -0.4 0
373288 131312706 2 FOSH4C5 ABCD4E5 -145.84 2.12 -8.56 -1.17 0
373289 131312718 1 BrNO3H10C11 ABC3D10E11 -50.72 6.6 -9.38 -1.25 0
373290 131312732 1 BrO2N3C10H10 AB2C3D10E10 -24.06 1.43 -9.56 -1.45 0
373291 131312761 1 NSO4H7C10 ABC4D7E10 -48.89 9.08 -9.67 -1.85 0