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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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329581 126738596 2 NH18C24 AB18C24 256.87 3.09 -7.76 -0.7 0
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329582 126738599 1 N2H42C51 A2B42C51 179.9 3.23 -7.87 -0.57 0
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329583 126738600 1 N2H34C49 A2B34C49 202.95 2.49 -7.82 -0.59 0
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329584 126738612 1 N2H40C55 A2B40C55 223.79 1.98 -7.97 -0.65 0
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329585 126738633 1 NSF2O2H13C17 ABC2D2E13F17 -100.04 0.94 -8.89 -1.26 0
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329586 126738640 2 NH18C23 AB18C23 158.51 1.69 -7.79 -0.6 0
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329587 126738671 1 SN5O6C31H37 AB5C6D31E37 -151.16 8.78 -8.74 -0.75 0
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329588 126738682 2 OC18H25 AB18C25 -112.93 2.51 -9.49 0.09 0
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329589 126738688 1 OSN4H16C20 ABC4D16E20 73.47 2.79 -8.64 -0.91 0
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329590 126738698 1 FN3O3C22H30 AB3C3D22E30 -192.37 4.43 -8.52 -0.22 0
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329591 126738735 3 NC11H13 AB11C13 93.59 6.11 -7.97 -0.24 0
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329592 126738740 1 N5O7C37H63 A5B7C37D63 -356.07 4.59 -9.15 0.02 0
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329593 126738786 2 BrSN2F3O3H15C21 ABC2D3E3F15G21 -355.81 23.84 -8.56 -2.27 2
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329594 126738791 4 NH8C10 AB8C10 200.8 1.86 -6.5 -0.66 2
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329595 126738811 2 N3H15C16 A3B15C16 169.8 6.01 -6.04 -0.04 0
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329596 126738823 1 N2S3F6O6C40H40 A2B3C6D6E40F40 -192.48 65.4 -8.36 -5.41 0
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329597 126738867 1 O3N4C12H22 A3B4C12D22 -93.29 4.18 -9.58 -0.07 0
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329598 126738873 1 NO4C18H25 AB4C18D25 -73.8 6.44 -10.17 -1.31 2
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329599 126738875 1 SN2H28C36 AB2C28D36 174.48 1.47 -6.43 -0.64 0
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329600 126738876 2 SN2F3O3H22C25 AB2C3D3E22F25 -251.31 13.66 -7.4 -1.04 0
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329601 126738925 2 NH20C25 AB20C25 174.66 2.9 -7.82 -0.65 0
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329602 126738937 1 BrO3N4C23H23 AB3C4D23E23 -63.85 6.1 -9.43 -1.36 0
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329603 126738938 1 BrO3N4C23H23 AB3C4D23E23 -58.3 6.22 -9.4 -1.39 0
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329604 126738961 1 FON5C28H34 ABC5D28E34 -39.79 9.39 -8.83 -1.36 0
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329605 126738971 1 OF3N5C25H28 AB3C5D25E28 -123.5 8.11 -9.01 -1.57 0
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329606 126739012 1 FO2N5C28H34 AB2C5D28E34 -80.06 7.8 -8.93 -1.45 0
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329607 126739046 1 FO2N5C26H30 AB2C5D26E30 -37.4 9.29 -8.94 -1.48 0
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329608 126739081 1 OF3N5C28H32 AB3C5D28E32 -133.59 8.36 -8.97 -1.51 0
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329609 126920291 1 N7H17C18 A7B17C18 166.92 5.77 -8.86 -1.25 0
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329610 126920294 1 ON8C14H16 AB8C14D16 114.42 7.47 -9.31 -1.18 0
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329611 126920296 1 SO3N7C17H17 AB3C7D17E17 75.59 10.55 -9.32 -1.09 0
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329612 126920297 1 SO2N7C15H23 AB2C7D15E23 27.09 9.14 -9.45 -1.09 0
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329613 126920339 1 SN7C16H19 AB7C16D19 130.34 8.95 -8.78 -0.97 0
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329614 126920350 1 N9C15H19 A9B15C19 156.16 7.86 -8.78 -1.13 0
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329615 126920353 1 FN8C13H13 AB8C13D13 116.89 7.95 -9.56 -1.15 0
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329616 126920354 2 N4C8H9 A4B8C9 145.97 9.27 -9.33 -1.01 0
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329617 126920360 3 N3C5H5 A3B5C5 199.35 9.91 -9.26 -1.06 0
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329618 126920363 1 ON6C15H22 AB6C15D22 50.42 10.08 -9.3 -0.97 0
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329619 126920365 1 SN6C14H20 AB6C14D20 107.54 6.56 -8.56 -1.1 0
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329620 126920369 1 SN7C13H15 AB7C13D15 141.83 7.33 -8.96 -1.14 0
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329621 126920373 1 N8C17H20 A8B17C20 136.74 7.84 -9.14 -1.14 0
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329622 126920374 1 ON8C18H18 AB8C18D18 115.81 6.64 -9.14 -1.07 0
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329623 126920378 1 N9C16H17 A9B16C17 169.14 8.32 -9.02 -1.13 0
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329624 126920384 1 N9C17H17 A9B17C17 180.5 4.34 -9.4 -1.28 0
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329625 126920385 1 N9H15C16 A9B15C16 188.32 7.97 -9.47 -1.32 0
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329626 126920387 1 ON9C17H17 AB9C17D17 129.34 8.73 -9.36 -1.19 0
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329627 126920397 1 ON6C15H20 AB6C15D20 61.91 5.22 -9.58 -1.2 0
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329628 126920401 1 OSN7H15C17 ABC7D15E17 134.72 6.6 -9.46 -1.55 0
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329629 126920403 1 ON8C18H18 AB8C18D18 130.49 5.66 -9.47 -1.18 0
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329630 126920404 1 ON8H16C18 AB8C16D18 149.32 4.43 -9.56 -1.64 0
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329631 126920405 1 O2N7C14H15 A2B7C14D15 96.28 10.12 -9.5 -1.12 0
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329632 126920410 1 ON6C16H20 AB6C16D20 79.59 5.41 -9.58 -1.2 0
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329633 126920413 1 OF3N7H14C16 AB3C7D14E16 -40.8 4.51 -9.78 -1.74 0
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329634 126920414 1 O2N7C14H15 A2B7C14D15 92.79 6.06 -9.54 -1.16 0
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329635 126920417 2 ON3C7H9 AB3C7D9 30.1 6.69 -9.53 -1.14 0
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329636 126920418 1 O2N6C15H20 A2B6C15D20 21.63 7.57 -9.61 -1.2 0
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329637 126920439 1 ON8C13H14 AB8C13D14 127.71 4.82 -9.72 -1.29 0
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329638 126920472 1 SO2N7C13H19 AB2C7D13E19 39.0 9.97 -9.28 -0.96 0
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329639 126920475 1 SO2N8C16H22 AB2C8D16E22 56.01 17.71 -9.04 -0.7 0
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329640 126920479 1 N8C13H14 A8B13C14 171.94 6.28 -9.18 -1.22 0
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329641 126920480 1 N9H13C14 A9B13C14 208.33 8.7 -9.51 -1.51 0
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329642 126920486 1 ClN7C14H14 AB7C14D14 149.38 7.0 -9.43 -1.14 0
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329643 126920489 1 BrN8C13H13 AB8C13D13 170.14 7.23 -9.35 -1.1 0
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329644 126920497 2 N5C8H9 A5B8C9 201.34 8.13 -9.49 -1.28 0
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329645 126920498 1 N10C15H16 A10B15C16 207.25 8.08 -9.46 -1.16 0
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329646 126920501 1 SN7C12H13 AB7C12D13 159.95 8.49 -9.11 -1.04 0
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329647 126920509 1 N7C16H25 A7B16C25 109.03 8.69 -8.85 -0.97 0
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329648 126920511 1 N7C15H17 A7B15C17 155.79 7.32 -9.42 -1.05 0
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329649 126920513 1 N7C16H25 A7B16C25 108.83 9.04 -8.87 -0.98 0
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329650 126920517 2 N3C8H12 A3B8C12 98.46 9.62 -9.25 -0.94 0
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329651 126920519 1 N8C17H18 A8B17C18 169.61 10.93 -9.24 -0.93 0
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329652 126920522 1 ON8C13H16 AB8C13D16 139.71 10.58 -9.26 -0.96 0
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329653 126920524 1 ON7C14H17 AB7C14D17 136.38 6.68 -9.51 -1.15 0
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329654 126920525 1 ON7C14H17 AB7C14D17 135.33 5.75 -9.44 -1.13 0
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329655 126920529 1 SO2N7H15C16 AB2C7D15E16 106.09 4.63 -9.75 -1.5 0