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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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81470 49854763 1 F3N3O4C18H18 A3B3C4D18E18 -244.54 10.14 -8.84 -1.04 0
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81471 49854764 1 Cl2N3O3H21C23 A2B3C3D21E23 -45.36 8.0 -8.81 -0.99 0
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81472 49854765 1 N2O5H24C29 A2B5C24D29 -102.47 12.47 -9.34 -1.27 0
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81473 49854766 1 N3O6H23C27 A3B6C23D27 -114.93 10.12 -9.36 -1.3 0
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81474 49854767 1 N3O5H23C28 A3B5C23D28 -93.23 12.48 -9.34 -1.26 0
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81475 49854768 1 FSN5O6C21H24 ABC5D6E21F24 -180.99 5.71 -7.76 -0.22 0
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81476 49854769 1 BrSO4N5C19H20 ABC4D5E19F20 -68.85 8.32 -8.18 -0.36 0
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81477 49854770 1 FSN5O5C20H22 ABC5D5E20F22 -146.31 1.15 -8.5 -0.76 0
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81478 49854771 1 BrSO4N6C26H33 ABC4D6E26F33 -86.18 9.89 -8.12 -0.28 0
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81479 49854772 1 ClSN5O6C21H24 ABC5D6E21F24 -147.52 9.2 -7.71 -0.39 0
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81480 49854773 1 SN4O6C26H32 AB4C6D26E32 -170.76 2.78 -9.15 -1.32 0
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81481 49854774 1 SN4O6C24H36 AB4C6D24E36 -224.05 4.14 -9.53 -0.67 0
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81482 49854775 1 SN2O6C27H34 AB2C6D27E34 -229.54 4.73 -9.2 -0.6 0
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81483 49854776 1 NS2O6C26H31 AB2C6D26E31 -220.58 6.41 -9.29 -1.27 0
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81484 49854777 1 N2O3C24H28 A2B3C24D28 -58.43 3.24 -8.64 -0.03 -2
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81485 49854778 1 SN2O16C38H72 AB2C16D38E72 -772.77 7.88 -8.99 -0.89 0
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81486 49854779 1 NaPN2O16C38H74 ABC2D16E38F74 -944.78 6.97 -8.62 0.22 2
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81488 49854781 1 SN4O4C8H14 AB4C4D8E14 -95.29 5.39 -9.19 -0.62 0
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81489 49854782 1 SN4O5C24H24 AB4C5D24E24 -79.27 7.03 -9.07 -1.17 0
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81490 49854783 1 FSN4O5H21C23 ABC4D5E21F23 -111.85 7.68 -9.31 -1.31 0
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81491 49854784 1 FSN4O5H21C23 ABC4D5E21F23 -124.17 7.7 -8.85 -1.51 0
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81492 49854786 1 FSN4O4H17C22 ABC4D4E17F22 -56.44 11.13 -8.88 -1.39 0
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81494 49854788 1 O3C27H40 A3B27C40 -123.81 4.86 -9.36 0.35 0
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81495 49854789 1 PSiO2C26H39 ABC2D26E39 -150.17 4.39 -8.99 -0.21 0
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81496 49854790 1 PSiO2C26H39 ABC2D26E39 -152.05 3.95 -8.65 -0.18 0