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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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10594 105276 1 N3C16H19 A3B16C19 60.18 2.09 -8.22 -0.61 0
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10595 105280 1 O4N5H17C20 A4B5C17D20 72.86 5.9 -8.74 -1.99 0
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10596 105285 1 PO3C24H33 AB3C24D33 -91.87 2.7 -9.33 0.97 0
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10597 105346 1 CuSNa2N6O9H22C33 ABC2D6E9F22G33 3.73 54.29 0.0 0.0 0
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10598 105350 1 Na2N6O7H22C29 A2B6C7D22E29 -117.22 32.0 -7.55 -2.58 0
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10599 105383 1 O5N7H23C38 A5B7C23D38 37.52 5.65 -9.19 -2.1 0
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10600 105385 1 NNaO3C22H44 ABC3D22E44 -155.36 52.83 -5.7 -3.29 0
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10601 105536 1 NC10H15 AB10C15 21.58 4.11 -9.8 -0.02 0
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10602 105537 1 O2C11H18 A2B11C18 -91.28 2.06 -9.67 0.8 0
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10603 105539 1 NOC7H11 ABC7D11 -32.66 3.03 -9.04 0.06 0
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10604 105540 1 NO3C4H9 AB3C4D9 -131.76 1.84 -9.75 0.17 0
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10605 105561 1 NC46H95 AB46C95 -209.4 1.19 -8.32 2.89 0
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10606 105621 1 ON2C23H48 AB2C23D48 -136.15 6.0 -9.06 1.36 0
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10607 105639 1 O2N3C11H14 A2B3C11D14 1.31 6.32 0.0 0.0 1
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10608 105643 1 O2C13H18 A2B13C18 -52.84 3.13 -9.11 -0.91 0
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10609 105656 1 O5H12C17 A5B12C17 -140.72 2.26 -9.87 -1.86 0
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10610 105658 1 O4H16C17 A4B16C17 -130.72 4.54 -9.72 -0.87 0
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10611 105660 4 OH3C4 AB3C4 -114.55 6.47 -9.47 -1.25 0
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10612 105682 1 O3C10H20 A3B10C20 -121.57 1.37 -9.6 1.29 0
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10613 105731 2 NOC9H15 ABC9D15 -87.84 1.02 -7.22 0.39 0
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10614 105751 1 ClO4H7C8 AB4C7D8 -158.56 3.19 -9.51 -0.83 0
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10615 105753 1 NO2H13C22 AB2C13D22 35.27 6.0 -9.01 -1.41 0
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10616 105755 1 O2C17H26 A2B17C26 -97.08 2.58 -9.33 0.94 0
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10617 105756 1 O2C13H26 A2B13C26 -149.77 1.66 -10.82 0.86 0
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10618 105761 1 O11C35H62 A11B35C62 -455.96 4.06 -7.43 -0.12 0
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10619 105765 1 OC15H30 AB15C30 -102.93 1.47 -9.52 2.38 0
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10620 105766 1 NC18H23 AB18C23 32.75 4.62 -8.16 0.31 0
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10621 105767 1 O2C13H18 A2B13C18 -72.73 2.92 -8.7 0.02 0
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10622 105769 1 O2C19H30 A2B19C30 -93.63 3.29 -9.17 0.46 0
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10623 105770 1 PN3O3C15H26 AB3C3D15E26 -134.99 2.05 -9.26 -0.77 0
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10624 105771 1 N2O5C28H52 A2B5C28D52 -270.85 1.82 -8.79 -0.03 0
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10625 105772 1 O4C17H18 A4B17C18 -118.37 3.71 -8.8 -0.79 0
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10626 105773 1 ZnCl4O8N12H24C28 AB4C8D12E24F28 184.49 9.31 -8.45 -3.25 2
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10627 105774 1 ZnCl4O4N6H12C14 AB4C4D6E12F14 88.67 19.83 -8.41 -3.37 0
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10628 105775 1 O2N3H6C7 A2B3C6D7 68.12 5.37 0.0 0.0 1
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10629 105780 1 NCl4O4H11C12 AB4C4D11E12 -172.19 4.48 -10.03 -1.75 0
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10630 105787 1 NPO4C16H38 ABC4D16E38 -311.08 3.5 -8.56 0.74 0
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10631 105807 1 SCl3N4O4H11C16 AB3C4D4E11F16 -49.25 8.76 -9.57 -1.68 0
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10633 105809 1 O4N5C18H18 A4B5C18D18 -2.77 2.06 0.0 0.0 1
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10634 105814 1 Cl2N3O3C15H15 A2B3C3D15E15 -64.63 2.85 -8.8 -0.99 0
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10635 105815 1 N3O3H14C15 A3B3C14D15 -10.55 9.52 0.0 0.0 1
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10636 105824 1 CuN3S4O15H19C21 AB3C4D15E19F21 -447.74 7.24 0.0 0.0 0
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10637 105839 1 SiN3C18H39 AB3C18D39 -48.18 3.38 -9.45 0.07 0
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10638 105882 1 SnS2O4C16H32 AB2C4D16E32 -251.34 3.81 -9.0 -0.83 -2
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10639 105910 1 SN4O6C22H22 AB4C6D22E22 -77.68 11.08 -8.47 -1.45 0
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10640 105948 1 SN4O5H18C20 AB4C5D18E20 -142.23 3.73 -8.51 -0.8 0
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10641 105979 1 ClSN2O4H13C17 ABC2D4E13F17 -74.12 5.47 -9.05 -1.57 0
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10642 106023 1 SN4O8C26H28 AB4C8D26E28 -267.79 3.66 -8.29 -2.26 0
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10643 106025 2 NO2H8C11 AB2C8D11 -87.25 4.78 -8.2 -1.71 0
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10644 106029 1 SnS3O6C19H36 AB3C6D19E36 -358.45 3.9 -9.14 -1.39 0