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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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395455 135025517 1 NOC26H33 ABC26D33 19.33 1.64 -8.26 -0.38 0
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395456 135025518 1 SiO5C28H46 AB5C28D46 -260.27 3.44 -9.24 -0.2 0
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395457 135025519 1 Si2O6C37H68 A2B6C37D68 -406.27 2.59 -8.77 0.31 0
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395458 135025522 1 NO8C20H23 AB8C20D23 -285.98 2.95 -9.73 -0.74 0
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395459 135025523 1 NO7C13H17 AB7C13D17 -262.16 1.63 -10.46 -0.54 0
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395460 135025530 1 NSiO7C36H53 ABC7D36E53 -328.91 5.01 -8.93 -0.61 0
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395461 135025531 1 NO6C19H31 AB6C19D31 -280.04 3.9 -9.61 0.43 0
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395462 135025533 3 NOC5H7 ABC5D7 -96.93 2.81 -9.11 -1.25 0
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395463 135025534 1 N3O3C16H23 A3B3C16D23 -103.32 3.15 -9.06 -1.24 0
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395464 135025535 1 N3O3C15H19 A3B3C15D19 -64.62 3.02 -9.16 -1.28 0
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395465 135025536 1 N3O3C18H25 A3B3C18D25 -103.0 2.76 -9.09 -1.23 0
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395466 135025537 1 N3O4C20H23 A3B4C20D23 -94.81 3.7 -9.24 -1.31 1
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395467 135025538 1 N2O2Si2C31H67 A2B2C2D31E67 -258.72 1.13 0.0 0.0 1
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395468 135025539 1 N2O2Si2C39H67 A2B2C2D39E67 -191.12 2.47 0.0 0.0 0
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395469 135025540 1 H26C37 A26B37 246.2 1.02 -7.28 -1.47 1
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395470 135025542 1 N4O4C43H51 A4B4C43D51 -47.35 5.07 0.0 0.0 1
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395471 135025543 1 PN4O5C53H54 AB4C5D53E54 -75.36 3.85 0.0 0.0 0
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395472 135025544 1 BrO4H15C16 AB4C15D16 -131.9 5.97 -9.88 -0.51 0
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395473 135025545 1 OH9C11 AB9C11 58.59 3.45 0.0 0.0 0
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395474 135025546 1 N3O3H27C34 A3B3C27D34 58.9 1.15 -9.24 -0.68 0
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395475 135025548 1 SO2N3H15C18 AB2C3D15E18 5.82 5.57 -8.25 -1.07 0
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395476 135025549 1 ClMgNC4H8 ABCD4E8 -13.79 12.84 -6.92 -0.9 0
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395477 135025550 1 Cl2O3C10H12 A2B3C10D12 -151.36 5.64 -10.67 -1.09 0
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395478 135025551 1 OC14H16 AB14C16 -19.99 3.53 -9.57 0.12 0
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395479 135025558 1 NO7C38H41 AB7C38D41 -198.99 2.13 -9.01 -0.03 0
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395480 135025564 1 NO5C27H31 AB5C27D31 -133.87 1.98 -9.35 0.03 0
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395481 135025568 1 NO5C33H35 AB5C33D35 -114.4 2.51 -9.24 -0.05 0
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395482 135025569 1 NO6C37H39 AB6C37D39 -150.34 2.22 -8.94 -0.07 -1
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395483 135025575 1 MnN2H7C8 AB2C7D8 231.14 9.81 -8.34 -3.16 0
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395484 135025577 1 NH23C25 AB23C25 133.87 0.91 -8.97 -0.16 0
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395485 135025578 1 NH19C20 AB19C20 104.27 1.31 -9.04 -0.19 0
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395486 135025580 2 O2C8H9 A2B8C9 -135.89 2.4 -9.55 -0.92 0
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395487 135025583 1 BrO4C10H11 AB4C10D11 -156.99 5.59 -10.84 -0.54 0
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395488 135025584 1 O4C17H18 A4B17C18 -114.14 3.08 -9.59 0.12 0
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395489 135025586 1 NOF4H7C16 ABC4D7E16 -109.61 4.29 -10.21 -2.03 0
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395490 135025587 1 O5C10H12 A5B10C12 -202.22 4.45 -10.04 -0.65 0
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395491 135025588 1 FNOH10C14 ABCD10E14 -1.59 2.13 -9.99 -0.93 0
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395492 135025590 1 O5C22H32 A5B22C32 -227.76 1.19 -8.51 0.01 0
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395493 135025592 1 NO3C24H27 AB3C24D27 -69.67 2.65 -8.6 -0.2 0
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395494 135025596 2 NC8H13 AB8C13 -17.92 2.38 -9.49 0.09 0
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395496 135025619 1 NO3C10H16 AB3C10D16 -59.34 3.31 0.0 0.0 0
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395498 135025624 1 ClNF3O3H15C19 ABC3D3E15F19 -235.01 6.55 -8.87 -1.06 0
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395499 135025627 1 NO8C21H21 AB8C21D21 -270.84 5.04 -10.39 -1.54 0
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395500 135025631 1 NOC15H17 ABC15D17 0.26 3.7 -9.14 -0.35 0
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395501 135025634 1 NPO7C17H26 ABC7D17E26 -315.31 6.44 -9.87 -0.72 -1
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395502 135025636 1 NOC14H16 ABC14D16 26.69 2.5 0.0 0.0 0
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395503 135025638 1 SO4N6H18C20 AB4C6D18E20 -3.84 5.23 -8.99 -1.24 1
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395504 135025639 1 SO2N4C54H59 AB2C4D54E59 51.48 2.82 0.0 0.0 1
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395505 135025640 1 O4N5C39H46 A4B5C39D46 -77.39 4.78 0.0 0.0 1
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395506 135025641 1 SO2N4C35H45 AB2C4D35E45 -28.73 3.03 0.0 0.0 0
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395507 135025647 1 NO3H7C9 AB3C7D9 -94.15 4.95 -9.91 -0.97 0
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395508 135025664 1 NSO4C23H23 ABC4D23E23 -95.62 2.02 -8.82 -0.52 0
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395509 135025674 1 O3C12H20 A3B12C20 -130.58 4.29 -9.72 0.49 0
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395510 135025678 1 SSiF3O3H31C44 ABC3D3E31F44 -134.03 3.23 -8.18 -1.55 0
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395511 135025681 1 NC23H35 AB23C35 26.28 1.55 -8.58 0.0 0
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395512 135025682 1 NSO3C16H23 ABC3D16E23 -66.41 4.99 -8.34 -0.55 0
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395513 135025684 1 NSO5C21H27 ABC5D21E27 -105.74 5.85 -8.97 -0.37 0
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395514 135025685 1 NC10H19 AB10C19 -25.97 1.35 -8.24 3.01 0
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395515 135025686 1 NO6C19H31 AB6C19D31 -275.83 2.13 -9.8 0.15 0
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395516 135025687 1 ON4C16H16 AB4C16D16 71.16 4.92 -8.77 -1.55 0
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395517 135025688 1 O3N4H18C24 A3B4C18D24 27.64 3.01 -8.33 -1.08 1
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395519 135025694 1 NO2C17H17 AB2C17D17 -23.4 5.2 -8.2 0.09 0
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395520 135025697 1 B2O5H42C52 A2B5C42D52 -208.85 1.94 -8.37 -0.53 0
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395522 135025704 1 N3O6H19C22 A3B6C19D22 -158.98 3.92 -8.77 -2.12 0
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395523 135025705 1 N3O6H17C21 A3B6C17D21 -161.56 6.73 -8.93 -2.22 0
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395524 135025706 1 NO3H17C18 AB3C17D18 -76.71 5.23 -9.23 -0.52 0
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395525 135025708 1 NO4C22H27 AB4C22D27 -158.26 2.48 -8.68 -0.34 0
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395526 135025709 1 O5C6H12 A5B6C12 -241.63 1.32 -10.51 1.0 0
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395527 135025710 1 BrClON3H11C19 ABCD3E11F19 81.16 6.85 -8.82 -1.39 0
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395528 135025711 1 ON3H17C21 AB3C17D21 70.84 3.56 -8.7 -0.98 0
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395529 135025712 1 INOH18C23 ABCD18E23 102.28 4.05 -9.17 -1.2 0
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395530 135025713 1 INOH18C23 ABCD18E23 99.97 3.7 -9.07 -1.06 0
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395531 135025714 1 INOH18C23 ABCD18E23 89.36 4.37 -9.08 -1.01 0
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395532 135025715 1 ClINOH15C22 ABCDE15F22 98.8 2.4 -9.27 -1.2 0
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395533 135025716 1 ClINOH15C22 ABCDE15F22 98.4 3.07 -9.32 -1.19 0