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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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43383 10321209 1 NSiO3C26H41 ABC3D26E41 -161.23 3.43 -8.22 0.25 0
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43385 10321213 1 ClSO2N3C23H26 ABC2D3E23F26 -4.49 3.14 -8.81 -0.86 0
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43386 10321214 1 BrCuNSZnO2C12H13 ABCDEF2G12H13 14.78 5.68 -9.17 -1.62 0
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43387 10321215 1 ClOSiZnF6C14H17 ABCDE6F14G17 -344.85 10.78 -7.84 -1.22 0
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43388 10321216 1 OSiF6C14H18 ABC6D14E18 -407.4 1.5 -9.24 -0.97 0
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43389 10321218 1 OCl2F2N3H13C22 AB2C2D3E13F22 -50.18 5.39 -9.2 -1.2 0
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43390 10321219 1 IN2O2S2H13C15 AB2C2D2E13F15 29.3 3.07 -9.2 -1.75 0
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43391 10321221 1 BrN3O4C19H30 AB3C4D19E30 -191.93 5.87 -8.54 -0.92 1
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43392 10321222 1 N3O4C19H30 A3B4C19D30 -172.94 3.38 0.0 0.0 0
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43393 10321223 1 O2F3N6H19C21 A2B3C6D19E21 -100.77 4.23 -8.69 -1.65 0
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43394 10321225 1 O7H20C26 A7B20C26 -190.82 5.78 -9.3 -1.76 0
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43395 10321226 1 OF3N6C22H23 AB3C6D22E23 -130.38 6.24 -8.66 -1.01 0
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43396 10321229 1 F2N2S2O3H14C21 A2B2C2D3E14F21 -86.08 3.44 -9.47 -1.61 0
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43397 10321231 1 N2O7C23H28 A2B7C23D28 -221.73 8.86 -9.07 -1.39 0
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43398 10321232 1 N2O7C23H28 A2B7C23D28 -212.05 7.5 -9.69 -1.2 0
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43399 10321233 2 N2O3C11H14 A2B3C11D14 -171.41 7.01 -8.47 -0.99 0
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43400 10321236 2 ON2H10C14 AB2C10D14 108.53 7.88 -9.45 -1.19 0
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43401 10321237 2 ON2H10C14 AB2C10D14 78.97 7.82 -9.26 -1.78 0
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43402 10321238 1 SF2N2O5C20H26 AB2C2D5E20F26 -265.75 2.71 -8.68 -0.8 0
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43403 10321242 1 N2O4C27H28 A2B4C27D28 -64.48 5.06 -9.5 -0.22 0
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43404 10321244 1 SN2O5C23H28 AB2C5D23E28 -190.19 4.15 -9.34 -0.43 0
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43405 10321245 1 SiF2O2H22C27 AB2C2D22E27 -97.9 3.61 -8.99 -0.26 0
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43406 10321246 1 SN2O3H24C26 AB2C3D24E26 -43.12 9.55 -9.07 -1.13 0
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43407 10321247 1 SO2N4H24C25 AB2C4D24E25 17.85 3.56 -8.64 -0.61 0
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43408 10321248 1 N2O5C25H36 A2B5C25D36 -183.88 3.96 -8.62 -0.07 0
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43409 10321249 1 O2N4C27H32 A2B4C27D32 8.14 4.5 -8.83 -0.67 0
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43410 10321251 1 SN2O2C27H28 AB2C2D27E28 -13.27 5.91 -8.44 -0.67 0
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43411 10321252 1 SiN2O5C23H32 AB2C5D23E32 -149.28 6.89 -8.88 -1.22 0
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43412 10321253 1 O5C27H40 A5B27C40 -243.9 9.94 -9.04 -0.47 0
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43413 10321257 1 SO3C27H40 AB3C27D40 -163.69 4.47 -8.77 -0.34 0
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43414 10321258 1 SO3C27H40 AB3C27D40 -165.87 6.1 -8.89 -0.45 0
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43415 10321259 1 O3C29H48 A3B29C48 -214.02 2.61 -9.32 0.78 0
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43416 10321260 1 O3C29H48 A3B29C48 -183.21 3.24 -9.09 0.87 0
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43417 10321263 2 OC15H25 AB15C25 -100.05 3.18 -8.9 1.01 0
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43418 10321264 1 SiO2S2C24H32 AB2C2D24E32 -88.33 2.56 -8.32 0.06 0
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43419 10321265 2 OC15H26 AB15C26 -142.5 1.34 -9.01 1.42 0
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43420 10321266 2 OC15H26 AB15C26 -172.75 2.58 -9.15 1.55 0
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43421 10321268 1 ClN2O4H17C25 AB2C4D17E25 -23.71 6.27 -9.07 -0.97 0
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43422 10321269 1 ClN4O5C21H21 AB4C5D21E21 -143.26 7.26 -8.56 -0.68 0
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43423 10321270 1 ClON8H17C22 ABC8D17E22 122.19 6.86 -9.16 -1.28 0
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43424 10321271 1 ClON4H25C26 ABC4D25E26 55.49 2.3 -8.89 -1.31 0
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43425 10321273 1 ClSN2O3C23H25 ABC2D3E23F25 -37.5 6.08 -7.06 -0.74 0
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43426 10321276 1 BrFN2O4H14C20 ABC2D4E14F20 -127.02 4.64 -9.89 -1.4 0
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43427 10321277 1 BrN2O5H17C20 AB2C5D17E20 -94.09 3.17 -9.06 -1.08 0
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43428 10321278 1 PN7O8C14H20 AB7C8D14E20 -300.48 7.26 -9.51 -0.57 0
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43429 10321282 1 SCl2N2O2H18C22 AB2C2D2E18F22 -19.2 5.75 -8.44 -0.58 0
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43430 10321284 1 F2N3O5H21C22 A2B3C5D21E22 -180.08 11.9 -8.23 -1.06 0
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43431 10321285 1 F3N3O3H22C23 A3B3C3D22E23 -172.98 5.33 -9.51 -1.11 0
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43432 10321287 1 ON3F4H23C24 AB3C4D23E24 -197.36 1.92 -9.02 -0.92 0
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43433 10321288 1 NF3O3C25H26 AB3C3D25E26 -249.97 4.17 -9.11 -1.01 0
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43434 10321291 1 NO5C27H27 AB5C27D27 -140.62 10.4 -9.03 -0.63 0
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43435 10321292 1 N3O4C26H27 A3B4C26D27 -69.58 12.2 -7.93 -0.64 0
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43436 10321294 1 N3O4C26H27 A3B4C26D27 -91.28 2.31 -8.49 -0.72 0
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43437 10321295 1 O3N5C25H27 A3B5C25D27 29.12 4.93 -8.85 -1.51 0
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43438 10321296 1 O2N7C24H27 A2B7C24D27 50.17 8.03 -9.68 -0.78 0
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43439 10321297 1 FO2N3C27H28 AB2C3D27E28 -58.07 6.29 -8.37 -0.55 0
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43440 10321301 1 NPSO5C21H36 ABCD5E21F36 -315.26 5.6 -9.04 -0.59 0
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43441 10321302 1 N3O3C27H31 A3B3C27D31 -61.57 6.03 -9.87 -1.0 0
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43442 10321304 1 O4N5C23H35 A4B5C23D35 -159.71 6.3 -9.23 -1.01 0
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43443 10321305 1 NSO3C27H27 ABC3D27E27 -46.57 1.95 -8.85 -0.78 0
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43444 10321307 1 SO2N3C26H27 AB2C3D26E27 -37.15 2.34 -8.54 -0.63 0
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43445 10321309 1 NS2O4C23H27 AB2C4D23E27 -150.31 6.97 -9.21 -0.36 0
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43446 10321310 1 NS2O4C23H27 AB2C4D23E27 -157.2 5.69 -8.83 -0.13 0
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43447 10321311 1 O2N3C28H35 A2B3C28D35 -61.37 4.15 -8.2 0.16 0
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43448 10321312 1 O2N3C28H35 A2B3C28D35 -19.88 4.79 -8.21 0.08 0
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43449 10321313 1 NSO2C28H31 ABC2D28E31 -28.72 3.56 -8.68 -0.17 0
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43450 10321317 1 ClFN3O4H21C22 ABC3D4E21F22 -136.41 4.32 -8.61 -1.0 0
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43451 10321318 1 ClN3O3H20C25 AB3C3D20E25 2.49 7.24 -8.83 -0.93 0
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43452 10321319 1 ClSO3N5C20H20 ABC3D5E20F20 -30.47 7.26 -8.15 -0.85 0
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43453 10321320 1 ClOSN5H16C23 ABCD5E16F23 94.37 1.47 -9.37 -1.28 0
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43454 10321322 1 ClON3C27H28 ABC3D27E28 26.22 4.32 -8.59 -1.13 0
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43455 10321323 1 ClON7C22H32 ABC7D22E32 -15.18 2.07 -8.52 -0.32 0
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43456 10321327 1 FeC12O14H22 AB12C14D22 -621.13 3.3 -10.07 -0.67 0
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43457 10321328 1 ION4C19H19 ABC4D19E19 55.66 3.11 -8.63 -1.04 0
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43458 10321329 1 BrNSO4H16C20 ABCD4E16F20 -73.37 3.63 -8.86 -1.24 0