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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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94979 50005438 1 ClO5N6C28H35 AB5C6D28E35 -176.09 4.9 -9.15 -0.87 0
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94980 50005439 1 ClO5N6C31H41 AB5C6D31E41 -214.33 9.3 -8.87 -0.82 0
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94981 50005440 1 ClO5N6C33H37 AB5C6D33E37 -172.5 12.62 -8.63 -0.58 0
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94982 50005446 1 O5N6C28H36 A5B6C28D36 -189.83 10.82 -8.94 -0.57 0
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94983 50005454 1 O5N6C30H40 A5B6C30D40 -198.99 11.26 -9.0 -0.26 0
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94984 50005460 1 F2O4N5C26H31 A2B4C5D26E31 -231.95 8.66 -8.78 -0.66 0
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94985 50005474 1 O5N6C32H44 A5B6C32D44 -204.74 8.98 -9.13 -0.35 0
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94986 50005496 1 F2O5N6C33H36 A2B5C6D33E36 -248.26 4.31 -9.12 -0.53 0
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94987 50005499 1 FO5N6C34H39 AB5C6D34E39 -216.21 5.35 -8.73 -0.53 0
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94988 50005500 1 O5N6C34H40 A5B6C34D40 -168.33 5.49 -8.76 -0.45 0
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94989 50005505 1 FO5N6C34H39 AB5C6D34E39 -215.98 6.13 -8.91 -0.76 0
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94990 50005506 1 FO5N6C35H41 AB5C6D35E41 -222.92 12.54 -8.82 -0.85 0
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94991 50005527 2 N3O3C16H21 A3B3C16D21 -229.09 7.46 -8.94 -0.42 0
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94992 50005540 1 O5N6C29H38 A5B6C29D38 -196.35 5.06 -8.91 -0.26 0
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94993 50005556 1 FO5N6C34H39 AB5C6D34E39 -221.26 10.5 -8.8 -0.94 0
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94994 50005558 1 O5N6C35H42 A5B6C35D42 -175.4 8.7 -8.67 -0.43 0
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94995 50005559 1 FO5N6C34H39 AB5C6D34E39 -217.87 11.27 -8.93 -0.6 0
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94996 50005560 1 F2O5N6C34H38 A2B5C6D34E38 -262.6 13.54 -8.86 -0.56 0
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94998 50005599 1 ClO5N6C34H39 AB5C6D34E39 -183.88 7.36 -8.88 -0.63 0
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95000 50005613 1 ClO5N6C34H39 AB5C6D34E39 -179.95 6.27 -8.7 -0.31 0
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95001 50005618 1 ClO5N6C33H37 AB5C6D33E37 -172.22 6.84 -8.79 -0.7 0
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95002 50005619 1 O5N6C31H42 A5B6C31D42 -216.64 11.83 -8.8 -0.22 0
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95003 50005627 1 BrO4N5C26H32 AB4C5D26E32 -145.92 6.51 -8.97 -0.27 0
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95004 50005630 1 N6O6C35H42 A6B6C35D42 -203.19 9.59 -8.79 -0.38 0
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95005 50005657 1 N6O6C35H42 A6B6C35D42 -211.73 8.79 -8.32 -0.24 0
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95006 50005658 2 N3O3C17H20 A3B3C17D20 -200.01 12.22 -8.45 -0.53 0
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95007 50005667 1 Cl2O4N5C26H31 A2B4C5D26E31 -159.27 8.36 -8.88 -0.73 0
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95008 50005694 1 O5N6C34H46 A5B6C34D46 -218.39 9.21 -8.63 -0.09 0
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95009 50005710 1 FN6O6C34H39 AB6C6D34E39 -244.99 12.63 -8.84 -0.53 0
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95010 50005720 1 FO4N5C29H38 AB4C5D29E38 -211.85 5.82 -8.86 -0.36 0
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95011 50005729 1 N5O5C29H39 A5B5C29D39 -198.27 7.42 -8.84 -0.17 0
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95012 50005730 1 N5O5C30H41 A5B5C30D41 -207.76 10.2 -8.58 -0.16 0
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95013 50005745 1 O5N6C36H50 A5B6C36D50 -228.97 10.66 -8.82 -0.33 0
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95014 50005746 1 O5N6C33H46 A5B6C33D46 -224.06 2.86 -9.03 -0.36 0
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95015 50005747 1 Cl2O4N5C28H35 A2B4C5D28E35 -173.82 11.37 -8.92 -0.55 0
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95016 50005751 1 O5N6C33H46 A5B6C33D46 -216.12 6.33 -9.03 -0.29 0
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95017 50005762 1 O4N5C31H43 A4B5C31D43 -175.25 8.07 -8.94 -0.23 0
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95018 50005775 1 BrClO4N5C28H35 ABC4D5E28F35 -161.13 10.82 -9.18 -0.68 0
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95019 50005797 1 FO5N6C34H39 AB5C6D34E39 -216.1 10.93 -8.82 -0.45 0
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95020 50005800 1 F2O5N6C33H36 A2B5C6D33E36 -254.51 7.63 -8.9 -0.65 0
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95021 50005801 1 F2O5N6C33H36 A2B5C6D33E36 -249.95 2.59 -8.94 -0.95 0
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95022 50005802 1 BrO4N5C28H36 AB4C5D28E36 -157.71 9.3 -8.72 -0.44 0
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95023 50005803 1 ClO5N6C33H37 AB5C6D33E37 -173.19 13.21 -8.65 -0.72 0
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95024 50005806 2 N3O3C15H20 A3B3C15D20 -223.36 4.04 -8.79 -0.51 0
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95025 50005818 1 FO5N6C29H37 AB5C6D29E37 -250.29 12.2 -8.73 -0.58 0
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95026 50005819 1 ClO4N5C29H38 AB4C5D29E38 -173.77 8.95 -8.94 -0.25 0
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95027 50005823 1 N6O6C33H44 A6B6C33D44 -228.5 1.54 -8.95 -0.43 0
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95028 50005834 1 ClO5N6C33H37 AB5C6D33E37 -170.15 3.78 -8.54 -0.86 0
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95029 50005836 1 O5N6C33H38 A5B6C33D38 -156.53 8.21 -8.46 -0.38 0
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95030 50005837 1 FO5N6C33H37 AB5C6D33E37 -209.13 8.14 -8.75 -0.84 0
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95031 50005839 2 N3O3C17H20 A3B3C17D20 -207.94 10.24 -8.24 -0.51 0
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95032 50005840 2 N3O3C17H20 A3B3C17D20 -199.09 4.12 -8.41 -0.59 0
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95033 50005854 1 FN6O6C34H39 AB6C6D34E39 -239.09 2.38 -9.09 -0.73 0
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95034 50005857 1 FO5N6C34H39 AB5C6D34E39 -213.82 7.98 -8.86 -0.41 0
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95035 50005861 1 F2O5N6C33H36 A2B5C6D33E36 -249.72 8.09 -8.88 -0.62 0
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95036 50005902 1 O5N6C33H44 A5B6C33D44 -204.38 11.16 -8.87 -0.43 0
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95037 50005918 1 FO5N6C33H37 AB5C6D33E37 -204.22 12.4 -8.84 -0.8 0
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95038 50005919 1 ClO5N6C33H37 AB5C6D33E37 -173.21 8.64 -8.8 -0.64 0
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95039 50005923 1 O5N6C29H38 A5B6C29D38 -198.11 8.73 -8.89 -0.4 0
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95040 50005931 1 O5N6C34H40 A5B6C34D40 -168.18 10.06 -8.7 -0.43 0
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95041 50005932 1 ClO5N6C33H37 AB5C6D33E37 -167.81 12.75 -8.81 -0.79 0
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95042 50005937 1 ClO5N6C33H43 AB5C6D33E43 -221.48 11.67 -8.73 -0.53 0
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95043 50005959 1 BrO5N6C30H39 AB5C6D30E39 -203.95 8.81 -8.8 -1.17 0
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95044 50005966 1 ClO5N6C34H39 AB5C6D34E39 -179.73 8.09 -8.61 -0.54 0
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95045 50006004 1 FO5N6C34H39 AB5C6D34E39 -213.66 9.43 -9.11 -0.79 0
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95046 50006007 1 ClO5N6C30H39 AB5C6D30E39 -217.73 4.13 -8.89 -0.91 0
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95047 50006009 1 ClO5N6C31H39 AB5C6D31E39 -202.18 7.68 -9.04 -0.78 0
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95048 50006017 1 F2O5N6C33H36 A2B5C6D33E36 -253.87 6.43 -8.98 -1.01 0
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95049 50006030 1 ClN6O6C31H39 AB6C6D31E39 -234.58 13.85 -8.62 -1.01 0
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95050 50006033 1 ClO5N6C31H41 AB5C6D31E41 -223.93 13.54 -8.76 -1.06 0
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95051 50006034 1 ClO5N6C28H35 AB5C6D28E35 -200.79 5.47 -8.85 -0.89 0
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95052 50006044 2 N3O3C15H20 A3B3C15D20 -246.33 4.81 -8.45 -0.25 0
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95053 50006055 1 FO5N6C34H39 AB5C6D34E39 -214.9 8.55 -8.63 -0.64 0
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95054 50006073 1 FO5N6C34H39 AB5C6D34E39 -213.85 8.21 -8.71 -0.63 0
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95055 50006074 1 N6O6C35H42 A6B6C35D42 -207.96 8.8 -8.59 -0.31 0