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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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381557 134972329 1 N2O5C27H32 A2B5C27D32 -76.6 1.93 -9.17 0.05 0
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381558 134972330 1 SO7C15H20 AB7C15D20 -297.46 5.13 -10.29 -0.71 0
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381559 134972331 1 O5C17H22 A5B17C22 -163.4 3.0 -8.69 -0.06 0
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381560 134972333 1 NO8C28H41 AB8C28D41 -345.88 6.01 -8.99 -0.02 0
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381561 134972334 1 O2C15H24 A2B15C24 -107.29 1.79 -9.26 0.94 0
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381562 134972335 1 NSSiO3C23H33 ABCD3E23F33 -141.05 5.98 -9.15 -0.42 0
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381563 134972339 1 SiO6C16H30 AB6C16D30 -320.88 1.45 -8.8 -0.3 0
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381565 134972341 1 SO9C16H24 AB9C16D24 -425.75 0.88 -9.07 0.18 0
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381567 134972346 1 O5H16C20 A5B16C20 -89.59 2.96 -8.56 -0.83 0
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381568 134972347 2 NO2C6H10 AB2C6D10 -170.67 2.61 -9.39 -0.2 0
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381571 134972350 1 SiO4C27H44 AB4C27D44 -193.64 1.9 -8.68 0.32 0
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381572 134972351 1 OSC10H20 ABC10D20 -91.81 3.57 -8.64 0.85 0
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381573 134972352 1 O3C12H16 A3B12C16 -143.16 4.22 -9.57 -0.24 0
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381574 134972353 2 NOC9H12 ABC9D12 -56.44 1.07 -8.35 -1.69 0
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381575 134972354 1 N2O3C20H20 A2B3C20D20 -37.29 0.94 -8.47 -1.79 0
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381576 134972356 1 N3O4H15C22 A3B4C15D22 25.77 8.93 -8.77 -2.2 0
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381577 134972357 1 N2O3H22C25 A2B3C22D25 -22.16 2.85 -7.81 -1.72 0
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381578 134972359 1 SnO2C21H36 AB2C21D36 -98.88 6.13 -9.45 -0.78 0
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381579 134972360 2 NC5H6 AB5C6 95.11 4.57 -8.76 -0.18 0
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381580 134972361 2 OC5H9 AB5C9 -116.7 2.89 -9.93 1.11 0
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381581 134972362 1 OF3H9C10 AB3C9D10 -113.92 3.22 -9.81 -0.2 0
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381582 134972363 3 OC6H8 AB6C8 -132.56 2.16 -9.55 0.02 0
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381584 134972365 1 N2O5C14H20 A2B5C14D20 -154.57 2.95 -10.08 -0.7 0
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381585 134972367 1 SiO5C27H40 AB5C27D40 -223.31 2.44 -8.96 0.19 0
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381586 134972369 1 NSO4H17C19 ABC4D17E19 -104.65 4.38 -8.86 -1.49 0
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381587 134972370 1 ClN2O4C31H33 AB2C4D31E33 -79.24 3.72 -8.6 -0.59 0
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381588 134972371 1 ClNO4C30H36 ABC4D30E36 -137.28 3.82 -8.35 -0.03 0
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381589 134972372 1 ClNO4C30H36 ABC4D30E36 -136.05 4.51 -8.25 -0.12 0
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381590 134972373 1 ClNO3C26H26 ABC3D26E26 -65.73 3.45 -8.35 -0.26 0
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381591 134972374 1 ClNO3C26H26 ABC3D26E26 -63.9 2.31 -8.52 -0.32 0
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381592 134972375 1 ON3C28H37 AB3C28D37 -6.44 3.22 -8.86 0.08 0
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381593 134972376 1 O2C13H14 A2B13C14 -20.75 2.19 -9.53 0.22 0
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381594 134972377 1 NO3C8H13 AB3C8D13 -83.24 0.78 -10.19 0.31 0
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381595 134972378 1 O3C28H30 A3B28C30 -38.45 0.91 -9.26 0.23 0
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381596 134972379 2 O2C18H19 A2B18C19 -53.29 2.53 -9.21 0.21 0
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381597 134972380 1 NSO3H21C24 ABC3D21E24 -38.93 6.3 -8.83 -0.78 0
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381598 134972382 1 N3O3C16H19 A3B3C16D19 -91.92 4.06 -8.86 -0.38 0
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381599 134972384 1 NSO4H21C24 ABC4D21E24 -66.01 7.41 -8.22 -0.71 0
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381600 134972386 1 NO2C16H23 AB2C16D23 -67.89 3.1 -8.55 0.33 0
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381601 134972389 2 O4H9C13 A4B9C13 -276.41 6.48 -10.13 -1.56 0
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381602 134972390 2 OH7C8 AB7C8 137.61 1.49 -8.68 -0.62 0
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381603 134972391 1 O3H10C11 A3B10C11 -26.1 5.33 -10.52 -0.89 0
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381604 134972392 1 SiO2C30H32 AB2C30D32 -46.16 1.71 -8.86 -0.08 0
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381605 134972394 2 NO2H6C9 AB2C6D9 -65.86 2.19 -9.42 -2.14 0
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381606 134972395 1 O3H10C19 A3B10C19 32.81 1.13 -9.81 -2.02 0
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381607 134972396 3 OH4C7 AB4C7 -9.51 3.56 -9.92 -1.92 2
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381608 134972397 1 N2O12C47H48 A2B12C47D48 -428.36 9.26 -7.08 -1.84 0
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381609 134972398 1 N2O12H46C47 A2B12C46D47 -424.19 5.34 -8.87 -2.03 0
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381610 134972399 1 O10C25H36 A10B25C36 -358.48 6.57 -9.91 -1.36 0
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381611 134972400 3 O4H12C13 A4B12C13 -380.4 3.92 -8.7 -1.94 0
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381612 134972401 1 SiO7C40H42 AB7C40D42 -264.69 1.39 -8.92 -1.79 0
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381613 134972402 1 SiO6C33H42 AB6C33D42 -252.8 3.77 -8.88 -0.95 0
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381615 134972404 1 CuC2H6 AB2C6 86.86 1.59 0.0 0.0 0
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381616 134972405 1 SC8H14 AB8C14 12.1 1.74 -8.56 0.77 0
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381617 134972408 1 N2O2C21H22 A2B2C21D22 -13.0 2.33 -8.73 -1.63 0
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381618 134972410 1 N2O3C19H20 A2B3C19D20 -52.76 4.83 -9.43 -0.25 0
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381619 134972411 1 N2O2H14C17 A2B2C14D17 -25.31 4.87 -9.39 -0.72 1
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381620 134972412 1 PO5C11H18 AB5C11D18 -200.52 3.2 0.0 0.0 0
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381621 134972413 1 N2F3H7C11 A2B3C7D11 -89.95 3.7 -9.22 -1.18 0
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381622 134972414 1 INO2H12C18 ABC2D12E18 81.9 4.62 -9.3 -1.6 0
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381623 134972415 1 NOSiS2C19H31 ABCD2E19F31 -88.87 1.11 -8.72 -0.75 0
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381624 134972416 1 SiO2C19H30 AB2C19D30 -98.71 3.07 -8.68 0.43 0
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381625 134972417 1 BrO2C11H11 AB2C11D11 -56.75 4.43 -8.42 -0.74 0
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381626 134972418 1 InC4H5 AB4C5 73.63 0.39 -8.3 1.52 0
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381627 134972419 1 O3H14C18 A3B14C18 4.48 3.48 -8.47 -0.67 0
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381628 134972420 1 N3O6C9H17 A3B6C9D17 -197.93 5.32 -9.91 -0.01 0
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381630 134972423 1 N5O8C26H47 A5B8C26D47 -438.58 2.68 -9.24 0.59 0
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381631 134972424 1 O10H26C31 A10B26C31 -324.01 5.91 -9.06 -1.83 0
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381634 134972430 1 SO9C16H24 AB9C16D24 -423.67 0.55 -8.95 0.26 0
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381636 134972432 1 SO17C28H40 AB17C28D40 -783.34 5.78 -8.99 0.21 0
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381639 134972435 2 NO2C8H13 AB2C8D13 -162.26 1.38 -9.33 -0.29 0
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381640 134972436 2 O2C9H13 A2B9C13 -195.34 1.89 -9.31 0.36 1
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381641 134972437 1 PRuCl2F5H11C18 ABC2D5E11F18 -18.27 5.73 0.0 0.0 0
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381642 134972438 1 SiO3C13H28 AB3C13D28 -224.64 2.89 -8.86 0.19 0
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381643 134972439 1 NO2C17H25 AB2C17D25 -98.09 2.95 -9.04 0.34 0
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381644 134972441 1 N2O3C24H26 A2B3C24D26 -46.2 4.06 -8.35 -1.53 0
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381645 134972442 2 O4C5H9 A4B5C9 -349.42 3.21 -10.02 -0.69 0
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381646 134972443 1 IO2C9H9 AB2C9D9 -41.78 5.04 -9.55 -1.32 0
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381647 134972444 1 NO5H21C22 AB5C21D22 -157.67 4.33 -8.63 -0.87 0
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381648 134972445 1 NO5C26H29 AB5C26D29 -94.67 0.9 -9.4 0.05 0
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381649 134972446 1 INSiO4C42H46 ABCD4E42F46 -27.13 1.41 -8.0 -0.86 0
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381650 134972447 1 NO4C8H13 AB4C8D13 -135.73 3.61 -9.85 -0.27 0
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381651 134972448 1 NSO5C19H31 ABC5D19E31 -252.18 5.34 -9.82 -0.05 0
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381652 134972449 1 O3H18C23 A3B18C23 -18.99 4.88 -9.09 -0.85 0
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381653 134972451 1 SO2N3C14H17 AB2C3D14E17 -1.43 7.17 -8.08 -0.53 0
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381654 134972452 1 NO3C15H17 AB3C15D17 12.76 7.78 -9.58 -1.24 0
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381655 134972453 1 NOF4H7C9 ABC4D7E9 -194.67 3.98 -9.09 -0.91 0
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381656 134972454 1 SO17C28H40 AB17C28D40 -777.75 4.0 -8.77 0.39 0
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381658 134972456 1 O26C39H54 A26B39C54 -1175.84 2.94 -10.12 0.33 0
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381659 134972457 1 O18C27H38 A18B27C38 -816.56 1.12 -10.52 0.38 0
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381660 134972458 1 NO18C39H43 AB18C39D43 -736.66 3.9 -9.7 -1.31 0
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381661 134972459 1 O16C25H36 A16B25C36 -715.96 4.48 -9.8 0.15 0
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381662 134972460 1 O18C27H38 A18B27C38 -812.27 4.87 -9.91 0.32 0
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381663 134972461 1 BrO4H17C22 AB4C17D22 -84.38 1.38 -9.64 -1.02 0
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381664 134972462 1 Br2N2O5C22H22 A2B2C5D22E22 -129.33 3.89 -9.58 -1.27 0
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381665 134972463 1 NC9H15 AB9C15 18.18 2.2 -8.14 1.04 0
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381667 134972465 1 NSSiC16H17 ABCD16E17 81.52 3.24 -8.62 -0.98 2
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381668 134972466 1 AuPH16C18 ABC16D18 135.45 1.52 -8.59 0.1 0
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381669 134972467 2 C4H5 A4B5 51.43 0.72 -9.09 0.34 0
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381670 134972468 1 NO3C30H41 AB3C30D41 -37.95 6.52 -8.78 -1.16 0