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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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1513 4625 1 ON2H10C13 AB2C10D13 22.98 1.89 -8.54 -1.12 0
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1514 4626 1 N2O3C6H10 A2B3C6D10 -140.06 2.16 -9.91 0.22 0
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1515 4628 1 NO5H11C13 AB5C11D13 -161.62 10.71 -9.24 -1.21 0
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1516 4629 1 ON2C11H19 AB2C11D19 22.52 3.57 0.0 0.0 1
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1517 4630 1 ON2C12H18 AB2C12D18 -1.4 4.62 -9.08 0.97 0
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1518 4631 1 NO3C15H23 AB3C15D23 -97.79 1.32 -8.44 0.2 0
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1519 4632 1 O3H12C14 A3B12C14 -69.11 4.42 -9.34 -0.48 0
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1520 4633 1 N2O3C17H28 A2B3C17D28 -129.66 2.61 -8.39 -0.39 0
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1521 4634 1 NO3C22H31 AB3C22D31 -82.15 2.59 -8.69 0.26 0
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1522 4637 1 NO4C19H27 AB4C19D27 -151.05 5.27 -8.5 -0.21 0
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1523 4641 1 N2O3C19H20 A2B3C19D20 -65.42 1.19 -8.71 -0.28 0
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1524 4642 1 N2O3C20H28 A2B3C20D28 -107.44 4.71 -9.01 0.27 0
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1525 4643 1 NO3C22H36 AB3C22D36 -118.71 3.65 0.0 0.0 1
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1526 4645 1 N2O9C22H24 A2B9C22D24 -349.9 0.88 -9.2 -1.03 0
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1527 4646 1 N2O2H12C13 A2B2C12D13 -9.76 4.07 -9.52 -1.29 0
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1528 4647 1 Cl2N2O3C11H14 A2B2C3D11E14 -129.21 4.54 -8.61 -0.49 0
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1529 4649 1 NO3C7H7 AB3C7D7 -116.22 7.25 -9.33 -0.6 0
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1530 4650 2 OH2C3 AB2C3 -27.63 0.33 -10.59 -2.08 0
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1531 4651 1 N2O2C17H28 A2B2C17D28 -96.47 4.42 -8.62 -0.21 0
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1532 4652 1 ClNO2C9H10 ABC2D9E10 -77.21 2.67 -9.81 -0.62 0
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1533 4654 1 FNO2C9H10 ABC2D9E10 -115.09 2.71 -9.99 -0.55 0
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1534 4655 1 NOC10H15 ABC10D15 -36.21 2.77 -8.78 0.17 0
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1535 4656 1 ICl2N3H8C9 AB2C3D8E9 54.44 2.47 -9.16 -1.22 0
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1536 4658 1 IO2N4C25H27 AB2C4D25E27 31.08 3.79 -8.62 -1.04 0
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1537 4661 1 NO4H7C8 AB4C7D8 -71.76 3.31 -10.95 -1.82 0
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1538 4663 1 P5N7C20O23H30 A5B7C20D23E30 -1263.53 8.58 -9.53 -1.0 0
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1539 4664 1 SP3N10O14C21H29 AB3C10D14E21F29 -655.4 6.36 -8.97 -1.04 0
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1540 4665 1 ClFON3H13C20 ABCD3E13F20 27.42 3.58 -9.05 -1.42 0
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1541 4666 1 NO14C47H51 AB14C47D51 -470.11 12.69 -9.69 -0.74 0
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1542 4667 1 O4C25H38 A4B25C38 -191.38 4.99 -9.68 -1.08 0
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1543 4668 2 OC8H15 AB8C15 -146.16 1.74 -9.55 0.57 0
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1544 4669 1 NO4C22H44 AB4C22D44 -175.18 4.35 0.0 0.0 1
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1545 4670 1 OF3C17H31 AB3C17D31 -265.91 3.83 -10.88 -0.71 0
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1546 4671 1 NO2C18H37 AB2C18D37 -167.91 3.17 -9.88 1.02 0
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1547 4672 1 N3O53C130H225 A3B53C130D225 -2583.44 17.54 -9.67 -0.37 0
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1548 4673 1 NNa2P2C3O7H9 AB2C2D3E7F9 -538.07 6.59 -8.59 0.79 0
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1549 4675 1 N2O4C35H60 A2B4C35D60 -210.27 28.51 -6.89 -1.29 2
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1550 4678 1 NO4C9H19 AB4C9D19 -210.76 1.17 -9.73 1.06 0
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1551 4680 1 NO4C20H21 AB4C20D21 -82.12 3.43 -8.04 -0.6 0
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1552 4681 1 N13O21C66H105 A13B21C66D105 -944.44 5.44 -8.97 -0.86 0
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1553 4682 1 N13O21C65H103 A13B21C65D103 -993.78 2.28 -9.08 -0.1 0
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1554 4683 1 NSO7C12H17 ABC7D12E17 -235.1 1.82 -9.12 -0.85 0
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1555 4684 1 ClOH5C6 ABC5D6 -30.75 1.97 -9.12 -0.3 0
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1556 4688 1 NC11H13 AB11C13 78.15 0.92 -9.06 0.38 0
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1557 4689 1 N5O14C23H45 A5B14C23D45 -628.79 7.66 -9.39 0.58 0
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1558 4690 1 Cl2N2O3H6C9 A2B2C3D6E9 -68.66 1.98 -9.57 -1.39 0
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1559 4691 1 FNO3C19H20 ABC3D19E20 -113.08 2.06 -8.44 -0.22 0
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1560 4692 1 O3C15H20 A3B15C20 -89.43 7.98 -9.7 -0.31 0
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1561 4693 2 SO3N4C19H24 AB3C4D19E24 -173.71 10.94 -9.17 -1.24 0
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1562 4695 1 N2S2O6C27H33 A2B2C6D27E33 -186.29 3.45 0.0 0.0 1