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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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112717 50416765 1 FN5O5C37H38 AB5C5D37E38 -177.36 12.35 -8.69 -0.47 0
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112718 50417098 1 FO5N6C35H41 AB5C6D35E41 -220.59 4.75 -8.98 -1.0 0
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112719 50417208 1 ClO5N6C33H43 AB5C6D33E43 -208.71 11.72 -8.84 -0.62 0
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112720 50417235 1 O4F5N5H30C31 A4B5C5D30E31 -343.66 8.47 -9.05 -0.76 0
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112721 50417251 1 O5N6C36H48 A5B6C36D48 -203.51 3.95 -9.07 -0.26 0
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112722 50417252 1 O5N6C37H50 A5B6C37D50 -214.25 7.04 -8.9 -0.24 0
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112723 50417277 2 N3O3C20H25 A3B3C20D25 -229.96 8.3 -8.06 -0.23 0
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112724 50417287 1 ClO5N6C34H45 AB5C6D34E45 -214.18 6.45 -8.98 -0.67 0
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112725 50417389 1 ClO5N6C37H51 AB5C6D37E51 -222.69 13.01 -8.65 -0.58 0
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112726 50417390 1 ClO5N6C37H49 AB5C6D37E49 -217.92 3.84 -8.7 -0.73 0
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112727 50417391 1 ClO5N6C38H51 AB5C6D38E51 -221.21 3.11 -8.79 -0.72 0
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112728 50417392 1 ClO5N6C39H53 AB5C6D39E53 -228.21 6.99 -8.7 -0.63 0
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112729 50417393 1 ClN6O6C37H49 AB6C6D37E49 -244.98 5.44 -8.73 -0.85 0
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112730 50417394 1 ClO5N6C38H51 AB5C6D38E51 -225.58 2.8 -8.71 -0.72 0
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112731 50417395 1 ClO5N6C39H53 AB5C6D39E53 -231.73 4.58 -8.68 -0.85 0
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112732 50417396 1 ClO5N6C37H51 AB5C6D37E51 -235.13 4.36 -8.79 -0.46 0
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112733 50417419 1 F2O5N6C36H42 A2B5C6D36E42 -276.8 7.1 -8.92 -0.5 0
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112734 50417523 1 F3O5N6C40H41 A3B5C6D40E41 -284.92 1.85 -9.11 -0.59 0
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112735 50417524 1 F4O5N6H38C39 A4B5C6D38E39 -323.2 7.09 -8.73 -0.89 0
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112736 50417525 1 F4O5N6H38C39 A4B5C6D38E39 -320.86 6.51 -8.9 -0.56 0
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112737 50417526 1 F3O5N6C40H41 A3B5C6D40E41 -291.86 7.01 -8.99 -0.74 0
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112738 50417527 1 F3O5N6C40H41 A3B5C6D40E41 -289.01 6.27 -9.19 -0.68 0
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112739 50417528 1 ClF2O5N6C36H41 AB2C5D6E36F41 -291.34 5.02 -9.08 -1.12 0
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112740 50417529 1 ClF2O5N6C33H35 AB2C5D6E33F35 -268.87 3.72 -8.9 -0.79 0
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112741 50417530 1 ClF2O5N6C36H41 AB2C5D6E36F41 -272.75 6.96 -8.71 -0.92 0