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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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160449 57309797 1 SiO2C12H26 AB2C12D26 -142.22 1.44 -8.89 1.13 0
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160450 57309798 1 ClSO3N4C12H19 ABC3D4E12F19 -133.04 5.22 -8.93 -0.71 0
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160452 57309800 1 N2O7C34H48 A2B7C34D48 -341.82 3.52 -9.36 0.2 0
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160453 57309801 1 OC13H26 AB13C26 -113.45 2.35 -10.17 3.1 0
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160454 57309802 1 BSO4C9H21 ABC4D9E21 -283.18 1.65 -8.33 0.91 0
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160456 57309804 1 SN3O7C39H45 AB3C7D39E45 -143.96 6.38 -9.02 -1.11 0
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160457 57309805 1 SCl3N4H7C10 AB3C4D7E10 60.8 4.77 -9.27 -1.39 0
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160459 57309807 1 SO6C26H38 AB6C26D38 -263.59 7.71 -9.37 -0.29 0
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160460 57309808 1 O2S2N6C7H8 A2B2C6D7E8 99.08 5.23 -10.06 -1.98 0
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160461 57309809 1 SN4O7C16H18 AB4C7D16E18 -238.61 3.3 -10.15 -0.85 0
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160463 57309811 1 N3O6C31H47 A3B6C31D47 -290.54 5.71 -9.22 0.24 0
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160464 57309812 1 NO6C17H21 AB6C17D21 -200.58 3.99 -8.04 0.02 0
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160465 57309813 1 N2O3C25H30 A2B3C25D30 1.73 1.75 -8.84 -0.22 0
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160466 57309814 1 SN4O5C17H22 AB4C5D17E22 -143.42 8.69 -8.81 -0.36 0
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160467 57309815 1 NO3C22H27 AB3C22D27 -123.1 3.23 -8.9 -1.33 0
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160468 57309816 1 SiO3C16H30 AB3C16D30 -218.83 3.47 -9.61 0.04 0
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160470 57309818 1 O5C28H44 A5B28C44 -249.72 2.92 -9.27 -0.4 0
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160471 57309819 2 OC6H12 AB6C12 -140.63 4.85 -10.9 0.68 0
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160472 57309820 2 NSO2C4H5 ABC2D4E5 -78.92 7.37 -9.39 -0.96 0
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160474 57309822 1 NO10C14H27 AB10C14D27 -459.06 4.73 -10.0 0.51 0
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160475 57309823 1 N2O5H18C23 A2B5C18D23 -62.12 2.57 -8.64 -2.44 0
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160476 57309824 1 SN3O7C26H37 AB3C7D26E37 -272.68 5.36 -9.39 -0.88 0
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160477 57309825 1 NO3H11C12 AB3C11D12 -77.41 4.2 -9.17 -1.43 0
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160478 57309826 1 ClN3O4H18C20 AB3C4D18E20 -82.72 4.1 -9.5 -0.47 0
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160479 57309827 1 OPSN2F3C7H8 ABCD2E3F7G8 -237.81 5.37 -9.74 -0.93 0
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160480 57309828 1 SiN6C13H15 AB6C13D15 202.91 4.44 0.0 0.0 0
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160481 57309829 1 SO3N8H18C25 AB3C8D18E25 150.85 2.63 -8.86 -1.59 0
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160482 57309830 4 NC2H3 AB2C3 50.06 5.61 -8.64 0.1 0
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160483 57309831 2 OC13H22 AB13C22 -157.57 4.63 -9.64 1.01 0
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160484 57309832 1 ON2Si2C20H32 AB2C2D20E32 -92.23 7.76 -8.5 -0.4 0
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160486 57309834 1 N2O3C16H18 A2B3C16D18 -74.84 8.65 -9.22 -1.51 0
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160487 57309835 1 FN2O3C31H49 AB2C3D31E49 -146.95 6.67 -8.78 -0.83 0
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160488 57309836 1 NF3O4H10C11 AB3C4D10E11 -235.21 7.3 -10.96 -1.9 0
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160490 57309838 1 ClO5N6H9C14 AB5C6D9E14 -21.82 1.52 -9.34 -2.04 0
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160491 57309839 1 NO5C25H31 AB5C25D31 -205.1 6.49 -9.03 -0.18 0
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160494 57309842 1 PSi2O4C9H25 AB2C4D9E25 -326.62 3.54 -9.06 0.76 0
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160496 57309844 1 ON4H70C72 AB4C70D72 207.6 5.14 -8.18 0.06 0
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160497 57309845 1 SO4C7H8 AB4C7D8 -134.28 4.59 -10.67 -1.57 0
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160498 57309846 1 S2N3O10C21H21 A2B3C10D21E21 -298.55 4.91 -9.63 -1.71 1
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160499 57309847 1 PCl2O2C5H8 AB2C2D5E8 -140.3 4.33 0.0 0.0 0
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160501 57309849 1 OF2H10C13 AB2C10D13 -87.97 2.63 -8.86 -0.5 0
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160502 57309850 1 ClN3O3H8C13 AB3C3D8E13 -26.29 4.23 -10.32 -1.56 0
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160503 57309851 1 BrON3C26H32 ABC3D26E32 17.74 3.36 -8.91 0.01 0
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160505 57309853 1 NS2O3C15H17 AB2C3D15E17 -45.52 6.7 -8.49 -0.6 0
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160506 57309854 1 SO4C18H38 AB4C18D38 -250.57 3.37 -10.12 -0.03 0
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160507 57309855 1 SN4O6C24H26 AB4C6D24E26 -83.04 5.71 -9.25 -1.39 0
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160508 57309856 2 ClNOH6C7 ABCD6E7 -60.48 7.68 -9.54 -0.88 0
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160509 57309857 1 N5O5H23C25 A5B5C23D25 -80.9 4.41 -9.62 -1.15 0
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160511 57309859 1 FO2N3H20C21 AB2C3D20E21 -26.08 1.48 -9.16 -0.94 0
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160512 57309860 1 N3O4C28H31 A3B4C28D31 -103.95 4.66 -9.23 -1.19 0