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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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90427 49969604 1 O5N6C33H44 A5B6C33D44 -205.83 6.38 -8.96 -0.58 0
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90428 49969610 1 FO5N6C40H49 AB5C6D40E49 -243.54 4.57 -8.9 -0.91 0
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90429 49969611 1 O5N6C40H50 A5B6C40D50 -193.76 13.45 -8.73 -1.08 0
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90430 49969621 1 ClO5N6C33H43 AB5C6D33E43 -225.42 7.15 -8.84 -0.45 0
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90431 49969626 1 ClO5N6C39H47 AB5C6D39E47 -190.01 8.44 -8.58 -0.52 0
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90432 49969627 1 ClO5N6C38H45 AB5C6D38E45 -178.68 13.71 -8.89 -0.78 0
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90433 49969628 1 ClO5N6C35H47 AB5C6D35E47 -231.1 7.78 -8.2 -0.46 0
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90434 49969629 1 ClO5N6C34H45 AB5C6D34E45 -227.17 12.07 -8.01 -0.46 0
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90436 49969632 1 ClO5N6C38H51 AB5C6D38E51 -233.01 6.71 -8.51 -0.38 0
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90437 49969715 1 ClO5N6C36H47 AB5C6D36E47 -214.13 10.69 -8.87 -1.0 0
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90438 49969721 1 Cl2O4N5C33H43 A2B4C5D33E43 -188.72 8.74 -8.77 -0.77 0
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90439 49969722 1 ClF3O4N5C34H43 AB3C4D5E34F43 -346.69 7.0 -8.86 -0.99 0
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90440 49969723 1 N5O5C34H47 A5B5C34D47 -214.02 5.95 -8.26 -0.16 0
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90442 49969747 1 O5N6C38H52 A5B6C38D52 -218.01 5.71 -8.92 -0.19 0
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90443 49969772 1 F2O4N5C33H43 A2B4C5D33E43 -267.59 6.98 -8.83 -0.5 0
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90444 49969777 1 FO5N6C42H53 AB5C6D42E53 -252.09 9.86 -8.83 -0.4 0
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90445 49969780 1 ClO5N6C37H51 AB5C6D37E51 -238.12 12.25 -8.8 -0.76 0
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90446 49969783 1 ClO5N6C38H53 AB5C6D38E53 -240.14 9.18 -8.89 -0.46 0
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90447 49969796 1 FO5N6C40H49 AB5C6D40E49 -239.15 11.24 -8.82 -0.63 0
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90448 49969801 1 O5N6C39H48 A5B6C39D48 -188.15 4.63 -8.31 -0.28 0
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90449 49969809 1 ClO5N6C38H45 AB5C6D38E45 -184.16 10.43 -8.91 -1.05 0
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90450 49969817 1 BrO4N5C35H48 AB4C5D35E48 -190.21 6.75 -8.92 -0.23 0
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90451 49969819 1 BrO4N5C34H46 AB4C5D34E46 -184.27 7.82 -8.81 -0.44 0
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90452 49969821 1 N5O6C35H47 A5B6C35D47 -241.6 7.33 -8.39 -0.11 0
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90453 49969823 1 SO4N7C30H43 AB4C7D30E43 -153.44 12.92 -8.84 -0.72 0