List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
355260 127288192 1 N3O3C14H23 A3B3C14D23 -159.49 7.45 -9.73 0.59 0
355261 127288193 1 O2N3C12H21 A2B3C12D21 -96.58 8.82 -9.09 0.62 0
355262 127288194 1 N3O3C13H23 A3B3C13D23 -140.32 1.86 -8.88 0.62 0
355263 127288195 1 SO2N4C13H16 AB2C4D13E16 -23.64 4.55 -9.52 -0.91 0
355264 127288196 1 O3N6C15H22 A3B6C15D22 -101.42 11.74 -9.75 -0.49 0
355265 127288197 1 ON8C15H20 AB8C15D20 65.93 7.38 -8.66 -0.21 0
355266 127288198 1 SO2N4C13H22 AB2C4D13E22 -65.24 4.16 -9.09 0.04 0
355267 127288199 1 ON3C13H25 AB3C13D25 -52.12 5.96 -8.82 1.21 0
355268 127288200 1 ON3C13H25 AB3C13D25 -54.34 3.97 -8.81 1.0 0
355269 127288201 1 S2N3O3C17H27 A2B3C3D17E27 -148.34 4.01 -8.8 0.0 0
355270 127288202 1 N3O4C19H31 A3B4C19D31 -205.94 5.07 -9.16 0.46 0
355271 127288203 1 S2O4N5C14H19 A2B4C5D14E19 -85.24 5.27 -9.58 -1.21 0
355272 127288204 1 S2O4N5C14H19 A2B4C5D14E19 -88.54 7.5 -9.52 -1.45 0
355273 127288205 1 ON4C17H28 AB4C17D28 -38.07 3.67 -8.42 0.49 0
355274 127288206 1 ON5C17H27 AB5C17D27 -40.99 5.06 -8.8 0.15 0
355275 127288207 1 ON5C16H25 AB5C16D25 -35.61 6.21 -8.86 0.11 0
355276 127288208 1 O2N5C17H27 A2B5C17D27 -82.5 5.79 -8.92 0.06 0
355277 127288209 1 O2N6C17H24 A2B6C17D24 0.26 3.87 -8.78 -0.05 0
355278 127288210 1 ON6C18H26 AB6C18D26 43.86 2.15 -8.7 -0.08 0
355279 127288236 1 SN7C15H21 AB7C15D21 117.82 4.89 -8.65 -0.72 0
355280 127288237 1 F3N8H11C12 A3B8C11D12 -9.12 9.41 -10.14 -1.72 0
355281 127288238 1 O2N6C17H22 A2B6C17D22 -12.89 6.69 -9.08 -0.9 0
355282 127288239 1 SN6C15H20 AB6C15D20 102.04 5.86 -8.55 -0.67 0
355283 127288240 1 N6C17H22 A6B17C22 97.87 3.35 -8.68 -0.84 0
355284 127288241 1 N5C19H23 A5B19C23 81.23 4.22 -8.63 -0.54 0
355285 127288242 1 ON6C16H18 AB6C16D18 66.83 4.29 -9.19 -0.99 0
355286 127288243 1 ON6C18H22 AB6C18D22 49.17 2.35 -8.71 -0.58 0
355287 127288244 1 ON5C17H19 AB5C17D19 58.01 5.56 -8.97 -0.81 0
355288 127288245 1 ON7C17H23 AB7C17D23 48.81 1.59 -8.66 -0.48 0
355289 127288246 1 ON7C17H23 AB7C17D23 63.61 8.9 -9.1 -0.8 0
355290 127288247 1 SN6C15H20 AB6C15D20 93.36 6.51 -8.7 -0.85 0
355291 127288248 1 F3N8C13H13 A3B8C13D13 -8.19 5.59 -9.89 -1.62 0
355292 127288249 1 ON6C19H20 AB6C19D20 80.45 5.21 -8.67 -0.94 0
355293 127288250 2 N3C9H11 A3B9C11 88.65 2.82 -8.5 -0.53 0
355294 127288251 1 N7C17H25 A7B17C25 75.41 4.84 -8.83 -0.2 0
355295 127288252 1 O2N6C17H22 A2B6C17D22 -19.06 3.85 -8.82 -0.21 0
355296 127288253 1 O2N4C19H32 A2B4C19D32 -88.98 0.72 -8.96 0.23 0
355297 127288254 1 O2N5C14H21 A2B5C14D21 -14.34 2.7 -8.99 -0.1 0
355298 127288255 1 O3N5C15H23 A3B5C15D23 -96.6 4.76 -8.74 -0.02 0
355299 127288256 1 SO2N5C16H23 AB2C5D16E23 -24.48 4.77 -8.87 -0.35 0
355300 127288257 1 O2N4C19H32 A2B4C19D32 -92.6 3.91 -8.7 0.33 0
355301 127288258 1 O2N4C17H28 A2B4C17D28 -45.28 7.1 -8.69 0.18 0
355302 127288259 1 ON7C13H21 AB7C13D21 56.24 7.58 -9.19 -0.06 0
355303 127288260 1 ON7C15H25 AB7C15D25 40.67 5.42 -9.13 0.04 0
355304 127288261 1 ON6C17H26 AB6C17D26 40.63 3.2 -8.91 0.28 0
355305 127288262 1 ON6C17H26 AB6C17D26 42.06 3.02 -8.94 0.28 0
355306 127288263 1 ON6C17H28 AB6C17D28 9.95 2.97 -8.92 0.28 0
355307 127288264 1 O2N5C16H25 A2B5C16D25 -24.96 2.82 -8.97 -0.05 0
355308 127288265 1 ON6C14H22 AB6C14D22 33.04 4.07 -9.0 0.17 0
355309 127288266 1 O3N4C17H28 A3B4C17D28 -117.3 2.38 -9.03 0.18 0
355310 127288267 1 O3N4C18H20 A3B4C18D20 -51.75 1.33 -8.57 -0.48 0
355311 127288268 1 O2N5C13H17 A2B5C13D17 -30.19 4.61 -9.76 -0.66 0
355312 127288269 1 O2N5C17H25 A2B5C17D25 -75.53 3.89 -9.77 -0.62 0
355313 127288290 1 ON5C20H21 AB5C20D21 38.34 7.54 -8.54 -0.25 0
355314 127288291 1 O2N5C16H23 A2B5C16D23 -33.99 2.97 -9.27 -0.43 0
355315 127288292 1 ON6C15H16 AB6C15D16 67.88 5.71 -8.84 -0.88 0
355316 127288293 2 ON2C9H14 AB2C9D14 -71.04 3.23 -9.59 -0.57 0
355317 127288294 1 ON4C19H22 AB4C19D22 25.36 3.96 -9.15 -0.38 0
355318 127288295 1 O2N5C17H25 A2B5C17D25 -63.96 5.14 -9.26 -0.42 0
355319 127288296 1 OSN5C16H19 ABC5D16E19 24.86 2.44 -8.92 -0.52 0
355320 127288297 1 OSN5C15H17 ABC5D15E17 40.22 2.78 -8.84 -0.6 0
355321 127288298 1 O2N5C17H23 A2B5C17D23 -24.25 6.6 -9.2 -0.33 0
355322 127288299 2 N3C7H9 A3B7C9 102.78 8.76 -9.25 -0.21 0
355323 127288300 1 N6C13H18 A6B13C18 76.75 5.2 -9.37 -0.42 0
355324 127288301 2 N3C7H10 A3B7C10 71.67 6.15 -9.29 -0.32 0
355325 127288302 1 N6C13H18 A6B13C18 75.2 9.32 -9.35 -0.36 0
355326 127288303 2 N3C7H9 A3B7C9 77.78 5.63 -9.34 -0.4 0
355327 127288304 1 ON5C19H25 AB5C19D25 24.58 6.72 -8.61 -0.16 0
355328 127288305 1 ON5C19H25 AB5C19D25 21.08 5.28 -8.51 -0.08 0
355329 127288306 1 ON5C19H25 AB5C19D25 25.15 6.32 -8.39 -0.02 0
355330 127288307 1 ON5C17H27 AB5C17D27 -8.68 1.75 -8.56 -0.16 0
355331 127288308 1 ON7C17H25 AB7C17D25 42.07 5.93 -8.53 -0.3 0
355332 127288309 1 ON6C18H20 AB6C18D20 64.26 1.52 -8.64 -0.95 0
355333 127288310 1 ON6C16H20 AB6C16D20 45.54 6.97 -8.83 -0.44 0
355334 127288311 2 ON3C8H11 AB3C8D11 -17.29 9.46 -8.87 -0.44 0