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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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1362 4239 1 N4O4C9H15 A4B4C9D15 -71.68 4.88 0.0 0.0 1
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1363 4242 1 O11C36H61 A11B36C61 -556.59 6.82 0.0 0.0 -1
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1364 4243 1 O11C36H62 A11B36C62 -584.75 4.11 -9.24 0.47 0
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1365 4246 1 NO6C16H23 AB6C16D23 -240.06 2.42 -9.04 0.27 0
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1366 4247 1 SO2N3C17H25 AB2C3D17E25 -47.64 4.46 -8.9 -0.89 0
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1367 4249 1 FNO2C22H26 ABC2D22E26 -108.43 3.52 -8.95 -0.66 0
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1368 4250 1 SN2C12H16 AB2C12D16 46.33 2.03 -8.65 -0.4 0
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1369 4251 1 O7H10C15 A7B10C15 -217.62 11.7 -9.12 -1.86 0
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1370 4253 1 NO3C17H19 AB3C17D19 -78.09 4.55 -8.55 -0.01 0
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1372 4255 1 O3N4C10H16 A3B4C10D16 -49.66 6.3 -9.14 -0.92 0
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1373 4258 1 N2O9C18H18 A2B9C18D18 -315.87 8.53 -9.53 -1.08 0
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1374 4262 1 NO3C16H27 AB3C16D27 -166.16 3.43 -10.0 -0.92 0
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1375 4265 1 O8C27H44 A8B27C44 -410.8 4.4 -9.86 -0.65 0
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1376 4266 2 NOC2H3 ABC2D3 -24.7 5.62 -9.81 -0.39 0
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1377 4268 1 N4O16C51H72 A4B16C51D72 -591.21 15.83 -9.12 -1.32 0
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1378 4269 1 N4O17C50H72 A4B17C50D72 -664.53 7.61 -9.5 -0.91 0
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1379 4270 1 N4O13C46H62 A4B13C46D62 -455.11 8.43 -8.96 -0.93 0
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1380 4271 1 NO7C23H31 AB7C23D31 -282.64 8.29 -8.86 -0.78 0
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1381 4273 2 ON3C12H14 AB3C12D14 16.85 3.27 -8.26 0.05 0
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1382 4274 2 PO2C9H20 AB2C9D20 -245.96 1.44 -8.47 2.25 0
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1383 4278 2 ON2C3H6 AB2C3D6 -31.77 0.11 -9.49 -0.79 0
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1384 4280 1 NSO6C11H15 ABC6D11E15 -228.97 4.16 -9.71 -1.39 0
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1385 4283 2 N2C7H17 A2B7C17 -32.3 0.6 -8.71 3.0 0
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1386 4284 1 NOC12H17 ABC12D17 -41.41 4.63 -9.33 0.04 0
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1387 4287 1 SN2O3F5C14H15 AB2C3D5E14F15 -335.38 4.29 -10.23 -1.32 0
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1388 4288 1 SF2N2O3H12C14 AB2C2D3E12F14 -160.99 4.12 -10.25 -1.06 0
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1389 4293 1 N2O4S4C9H10 A2B4C4D9E10 -83.74 4.25 -9.24 -1.69 0
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1390 4295 1 ClN3O3H24C26 AB3C3D24E26 -49.5 1.2 -8.53 -0.86 0
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1391 4298 1 SN2O2C14H18 AB2C2D14E18 -43.46 6.83 -9.35 -0.98 0
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1392 4300 1 ClIO2N3H13C15 ABC2D3E13F15 -22.01 8.5 -9.17 -1.68 0
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1393 4302 1 NO5H7C11 AB5C7D11 -155.54 7.06 -9.78 -2.12 0
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1394 4305 1 ClSN2O2C15H19 ABC2D2E15F19 -58.05 6.2 -9.38 -1.26 0
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1395 4312 1 NPC6O8H10 ABC6D8E10 -413.91 5.79 -11.31 -0.74 0
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1396 4317 1 N2O5C15H28 A2B5C15D28 -270.0 5.37 -9.97 -0.19 0
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1397 4319 2 N2O3C19H24 A2B3C19D24 -205.38 4.29 -8.7 0.04 0
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1398 4320 1 ClO5N8C37H55 AB5C8D37E55 -204.88 4.51 -8.57 -0.94 0
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1399 4327 1 ON6H18C22 AB6C18D22 90.67 4.07 -8.59 -0.78 0
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1400 4328 1 PN2O3C20H27 AB2C3D20E27 -113.76 5.63 -9.0 -0.3 0
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1401 4329 1 N6O13C26H34 A6B13C26D34 -511.0 9.21 -9.82 -1.43 0
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1402 4331 1 SN3O4C19H35 AB3C4D19E35 -223.82 6.12 -8.7 0.14 0
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1403 4337 1 N5O10C33H39 A5B10C33D39 -425.29 6.5 -8.95 -1.32 0
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1404 4338 1 N6O10C29H36 A6B10C29D36 -347.7 10.05 -9.3 -1.49 0
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1405 4340 1 NSO4C8H13 ABC4D8E13 -165.14 4.55 -9.64 -0.63 0
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1406 4344 1 ON2C4H13 AB2C4D13 -8.96 2.64 0.0 0.0 1
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1407 4346 1 NSO6C21H27 ABC6D21E27 -204.08 6.55 -8.61 -0.57 0
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1408 4347 1 SN2O3C14H14 AB2C3D14E14 -67.66 2.28 -9.79 -1.03 0
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1409 4349 1 N3O5C26H33 A3B5C26D33 -200.67 3.69 -9.29 -0.18 0
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1410 4351 1 N2O2C9H20 A2B2C9D20 -128.19 1.97 -9.47 1.04 0
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1411 4355 1 O3N4C17H26 A3B4C17D26 -102.67 1.84 -9.24 -0.15 0
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1412 4356 1 N2O5C17H24 A2B5C17D24 -222.06 4.99 -9.73 0.02 0
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1413 4362 1 NO2C6H7 AB2C6D7 -59.51 1.08 -10.57 -1.5 0
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1414 4363 1 SN2O4C9H16 AB2C4D9E16 -186.12 4.61 -9.09 0.04 0
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1415 4365 1 SN2O4C15H20 AB2C4D15E20 -161.07 1.22 -8.57 0.01 0
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1416 4376 1 NO4C5H9 AB4C5D9 -176.81 4.69 -9.89 -0.24 0
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1417 4381 1 NO4C7H15 AB4C7D15 -187.8 5.49 -9.29 1.29 0
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1418 4385 1 N3O4C11H21 A3B4C11D21 -221.01 2.83 -9.89 0.38 0
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1419 4386 1 NO2H11C13 AB2C11D13 -34.46 5.52 -8.92 -0.7 0
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1420 4388 1 NO5C7H13 AB5C7D13 -234.6 4.29 -10.5 -0.05 0
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1421 4389 1 NO5C9H13 AB5C9D13 -229.05 6.31 -10.68 -0.44 0
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1422 4391 1 SN2O4C10H16 AB2C4D10E16 -149.7 7.34 -8.9 -0.6 0
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1423 4395 1 O2N3C7H15 A2B3C7D15 -91.89 7.98 -9.44 0.55 0
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1424 4400 1 O4N6C19H22 A4B6C19D22 -86.49 5.79 -9.02 -0.67 0
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1425 4403 1 PN5O7C11H16 AB5C7D11E16 -299.93 4.65 -8.94 -0.58 0
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1426 4404 1 N5O5C18H19 A5B5C18D19 -116.0 5.03 -9.06 -1.23 0
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1427 4406 1 SO4N5C27H31 AB4C5D27E31 -93.54 7.4 -9.52 -1.2 0
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1428 4407 2 ClH2O2C5 AB2C2D5 -118.34 0.5 -9.38 -2.34 0
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1429 4408 1 PO10C12H19 AB10C12D19 -511.13 4.21 -11.14 -0.12 0
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1430 4411 1 NO4C17H27 AB4C17D27 -190.71 4.17 -9.04 0.09 0
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1431 4414 1 SN2O5C21H21 AB2C5D21E21 -130.29 4.98 0.0 0.0 -1
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1432 4415 1 SN2O5C21H22 AB2C5D21E22 -160.01 1.29 -8.78 -0.66 0
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1433 4419 1 NO4C21H27 AB4C21D27 -138.08 5.9 -8.33 0.25 0
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1434 4422 1 NO3C21H25 AB3C21D25 -71.73 3.65 -8.44 0.14 0
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1435 4423 1 NO3C19H21 AB3C19D21 -59.58 3.05 -8.56 0.0 0
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1436 4428 1 NO4C20H23 AB4C20D23 -105.17 5.12 -8.82 -0.25 0
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1437 4430 1 N2O3C26H26 A2B3C26D26 4.31 2.32 -7.72 -0.26 0