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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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382310 134973380 1 S2N3O4C15H15 A2B3C4D15E15 -60.83 2.62 -9.28 -2.18 0
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382311 134973383 1 ClCuILiNF6H11C20 ABCDEF6G11H20 -206.06 10.58 -8.05 -1.44 0
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382312 134973384 1 NSO2H9C13 ABC2D9E13 -29.69 7.28 -8.96 -1.4 0
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382313 134973385 2 O2C5H7 A2B5C7 -181.33 0.46 -10.41 0.3 -1
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382314 134973387 1 OC10H17 AB10C17 -57.41 3.76 0.0 0.0 0
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382315 134973390 1 IO5C9H9 AB5C9D9 -85.76 8.87 -9.85 -2.6 1
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382316 134973393 1 PSO3N7C20H31 ABC3D7E20F31 -53.82 9.74 0.0 0.0 0
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382317 134973395 2 NO2C8H11 AB2C8D11 -161.9 7.67 -9.64 -0.28 0
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382318 134973396 1 SO5N7C11H13 AB5C7D11E13 -38.11 4.54 -9.36 -0.8 0
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382319 134973397 1 S3N6O26C44H66 A3B6C26D44E66 -1154.02 13.01 -8.47 -0.32 0
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382320 134973399 1 BrNH18C27 ABC18D27 147.67 3.35 -8.68 -0.44 0
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382321 134973400 1 NO2C27H29 AB2C27D29 -18.89 4.06 -8.89 -0.06 0
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382322 134973401 1 NO2C27H27 AB2C27D27 -4.49 5.42 -9.07 -0.12 0
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382323 134973402 1 N2O2C27H28 A2B2C27D28 30.62 3.5 -8.87 -0.07 0
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382324 134973404 4 NO2C3H5 AB2C3D5 -293.13 3.29 -10.21 -0.61 0
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382325 134973405 1 N4O8C19H30 A4B8C19D30 -300.67 3.08 -9.9 -0.78 0
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382326 134973406 1 NO9C12H21 AB9C12D21 -420.95 4.85 -10.1 -0.3 0
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382327 134973407 1 O6C21H22 A6B21C22 -179.53 3.87 -9.44 -0.52 0
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382328 134973408 1 NO9C24H27 AB9C24D27 -249.94 5.22 -9.5 -0.66 0
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382329 134973409 1 NO7C22H25 AB7C22D25 -169.77 4.95 -9.55 -0.24 0
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382330 134973410 1 N4O7C23H32 A4B7C23D32 -229.84 6.68 -9.59 -0.41 0
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382331 134973413 1 N4O7C23H32 A4B7C23D32 -229.53 6.58 -9.64 -0.38 0
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382332 134973414 1 N2O7C22H30 A2B7C22D30 -293.84 5.59 -9.62 -0.46 0
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382333 134973416 1 N2O6C15H18 A2B6C15D18 -124.98 1.92 -9.89 -0.88 0
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382334 134973418 1 SeO5H20C24 AB5C20D24 -97.78 6.21 -8.66 -0.93 0
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382335 134973420 1 SeO6C25H26 AB6C25D26 -170.78 2.81 -8.5 -0.49 0
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382336 134973422 1 SiO7C24H32 AB7C24D32 -282.31 3.4 -8.96 -0.64 0
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382337 134973423 1 SiO8C27H36 AB8C27D36 -330.42 1.41 -8.82 -0.77 0
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382338 134973424 1 SiO10C27H38 AB10C27D38 -441.27 3.97 -8.88 -0.77 0
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382339 134973425 1 SiO13C45H50 AB13C45D50 -512.87 2.61 -8.75 -0.68 0
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382340 134973426 1 O13H36C39 A13B36C39 -441.7 3.31 -9.99 -0.78 0
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382341 134973427 1 N3O12H35C39 A3B12C35D39 -320.66 1.13 -10.03 -0.99 0
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382342 134973428 1 SiO9C27H44 AB9C27D44 -441.27 4.59 -8.54 0.13 0
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382343 134973429 2 O2H11C12 A2B11C12 -35.64 1.84 -8.61 -0.13 0
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382344 134973434 1 OS3H4C5 AB3C4D5 -15.72 1.98 -9.15 -1.29 0
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382345 134973435 1 CNPPdH8 ABCDE8 85.04 3.8 -7.14 1.47 0
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382346 134973436 3 O7C17H26 A7B17C26 -957.87 7.62 -9.98 0.39 0
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382347 134973439 1 SO17C26H36 AB17C26D36 -771.31 5.55 -9.49 -0.32 0
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382348 134973440 1 SN2O17C34H38 AB2C17D34E38 -679.41 6.11 -9.66 -1.67 0
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382349 134973441 1 SO17C26H36 AB17C26D36 -765.04 6.5 -9.27 -0.05 0
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382350 134973442 1 SN2O17C34H38 AB2C17D34E38 -678.06 4.78 -9.68 -1.66 0
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382351 134973443 1 SO13C23H30 AB13C23D30 -563.56 6.53 -10.2 -0.85 0
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382352 134973444 1 N2O11C24H26 A2B11C24D26 -399.78 4.86 -9.87 -1.4 0
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382353 134973445 1 SO13C23H30 AB13C23D30 -567.42 5.41 -10.3 -0.72 0
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382354 134973446 1 N2O11C24H26 A2B11C24D26 -390.63 9.45 -9.61 -1.13 0
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382355 134973447 1 N2O7C29H30 A2B7C29D30 -177.24 2.64 -9.57 -0.48 1
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382356 134973448 1 ION2C9H12 ABC2D9E12 -5.93 5.32 0.0 0.0 0
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382357 134973449 2 O3C14H16 A3B14C16 -180.25 3.97 -9.49 0.03 0
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382358 134973450 1 NCl3O8C31H32 AB3C8D31E32 -270.08 3.98 -9.33 -1.22 0
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382359 134973453 1 O13C55H60 A13B55C60 -423.51 3.42 -9.39 -0.88 0
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382360 134973454 3 C3H4 A3B4 24.48 1.36 -8.43 0.57 0
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382362 134973458 1 SiN4O4C36H38 AB4C4D36E38 -84.25 2.54 -9.21 -0.85 0
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382363 134973461 1 SiN2O3C15H20 AB2C3D15E20 -113.6 4.74 -9.2 -0.75 0
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382364 134973465 1 NO2H19C24 AB2C19D24 35.52 3.28 -8.84 -1.42 0
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382366 134973472 1 CrO3C5H13 AB3C5D13 -21.83 5.05 0.0 0.0 0
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382367 134973474 1 O4N5C16H21 A4B5C16D21 -124.18 8.53 -9.28 -1.23 0
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382368 134973481 1 SiO5C35H62 AB5C35D62 -309.64 3.44 -9.01 0.5 0
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382369 134973482 1 BrMgOC2H3 ABCD2E3 -85.86 0.59 -9.41 -0.96 0
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382370 134973486 1 O7C19H22 A7B19C22 -256.65 2.74 -9.66 0.02 0
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382371 134973487 1 O6C19H20 A6B19C20 -186.91 5.46 -9.34 -0.58 0
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382372 134973491 1 SiO5C28H42 AB5C28D42 -246.57 3.1 -8.78 -0.02 0
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382373 134973495 1 N4O4H14C17 A4B4C14D17 -77.77 4.55 -9.2 -0.94 0
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382374 134973497 1 NO2C16H23 AB2C16D23 -89.1 4.33 -9.47 0.21 0
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382375 134973498 1 NC8H17 AB8C17 -23.67 1.59 -8.43 2.93 0
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382376 134973501 1 N5O5C17H19 A5B5C17D19 -153.6 4.95 -8.84 -0.86 0
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382377 134973503 1 O5C10H14 A5B10C14 -224.43 3.76 -10.44 -0.29 0
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382378 134973504 1 BrO7C13H17 AB7C13D17 -274.24 6.11 -10.78 -0.76 0
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382379 134973506 1 PN2O7H33C36 AB2C7D33E36 -176.48 7.79 -8.77 -0.74 -1
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382380 134973507 1 ZnO2N3C4H8 AB2C3D4E8 -11.24 4.06 0.0 0.0 0
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382381 134973508 1 O2N3H15C19 A2B3C15D19 52.28 12.48 -7.38 -1.42 0
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382382 134973509 1 NO4C20H31 AB4C20D31 -189.59 3.74 -9.12 0.39 1
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382383 134973511 1 BrO3N7H21C25 AB3C7D21E25 26.35 14.01 0.0 0.0 1
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382384 134973512 1 NOC8H14 ABC8D14 -45.86 4.84 0.0 0.0 0
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382385 134973514 2 O2C10H15 A2B10C15 -185.15 6.21 -9.54 -0.18 0
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382386 134973515 1 O7C34H62 A7B34C62 -422.92 3.29 -9.43 1.93 0
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382387 134973516 1 NOSiC12H23 ABCD12E23 -80.39 4.11 -9.7 1.42 0
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382388 134973517 1 SiO4C22H36 AB4C22D36 -237.94 2.42 -8.99 -0.03 0
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382389 134973520 1 N2O5C31H38 A2B5C31D38 -167.79 2.58 -8.36 -0.3 0
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382390 134973521 1 SN2O4C10H12 AB2C4D10E12 -120.47 2.48 -8.41 -0.72 0
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382391 134973523 1 O4C23H42 A4B23C42 -213.76 1.26 -10.01 1.28 0
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382392 134973524 1 SN2O5H14C15 AB2C5D14E15 -163.59 7.57 -9.25 -1.71 0
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382395 134973527 1 IO2C8H11 AB2C8D11 -58.39 5.82 -9.74 -0.98 0
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382396 134973528 1 OF3H13C17 AB3C13D17 -119.21 4.45 -8.6 -0.51 0
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382397 134973530 2 NO2F3H10C11 AB2C3D10E11 -464.33 3.49 -9.32 -1.18 0
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382398 134973531 1 PN3C4H8 AB3C4D8 19.95 3.52 -8.33 0.59 0
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382399 134973532 1 IO10C60H61 AB10C60D61 -241.67 2.68 -9.02 -1.04 0
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382400 134973533 1 IO10C60H61 AB10C60D61 -238.26 5.22 -8.96 -1.06 0
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382401 134973534 2 O6C31H32 A6B31C32 -343.74 7.15 -9.0 -0.57 0
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382402 134973536 1 BrNS2O4C18H22 ABC2D4E18F22 -130.0 3.87 -8.8 -0.59 0
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382403 134973537 1 O2Si2N3C12H29 A2B2C3D12E29 -155.3 3.11 -8.95 0.06 0
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382404 134973538 1 SiN3O3C10H23 AB3C3D10E23 -135.07 6.0 -9.64 0.22 0
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382405 134973540 1 SiO5C33H50 AB5C33D50 -249.5 3.87 -8.62 0.3 1
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382406 134973541 1 NO2H12C13 AB2C12D13 -13.86 7.11 0.0 0.0 0
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382408 134973544 1 SnC26H48 AB26C48 -40.64 1.14 -9.03 1.07 0
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382409 134973546 2 O3C9H11 A3B9C11 -228.54 1.38 -9.26 -0.26 0
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382410 134973547 1 N2O3H12C15 A2B3C12D15 -47.17 5.31 -9.52 -1.36 -1
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382411 134973549 1 NO2C9H10 AB2C9D10 20.06 2.4 0.0 0.0 0
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382412 134973550 1 ClO3H11C18 AB3C11D18 -26.23 3.67 -9.51 -1.96 0
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382413 134973552 1 NO3H11C18 AB3C11D18 -0.58 2.0 -9.28 -2.08 0
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382415 134973554 1 ClO5C19H29 AB5C19D29 -252.58 2.58 -10.03 -0.26 0