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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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114625 50490528 1 O5N6C33H38 A5B6C33D38 -170.76 9.67 -8.85 -0.71 0
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114626 50490529 1 O5N6C35H42 A5B6C35D42 -167.26 2.71 -8.68 -0.46 0
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114627 50490530 1 ClO5N6C38H45 AB5C6D38E45 -190.6 8.02 -8.63 -0.92 0
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114628 50490651 1 N5O5C33H39 A5B5C33D39 -167.51 3.27 -8.35 -0.34 0
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114629 50490680 1 FO5N6C40H47 AB5C6D40E47 -230.42 7.52 -9.14 -0.57 0
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114630 50490694 1 FN6O6C40H49 AB6C6D40E49 -266.02 3.32 -8.73 -0.6 0
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114631 50490695 1 O5N6C33H38 A5B6C33D38 -168.65 5.21 -8.35 -0.46 0
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114632 50490696 1 O4N5C34H41 A4B5C34D41 -132.92 5.29 -8.57 -0.4 0
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114633 50490697 1 ClO4N5C32H36 AB4C5D32E36 -139.35 4.13 -8.67 -0.47 0
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114634 50490698 1 ClO4N5C32H36 AB4C5D32E36 -140.54 6.4 -8.68 -0.46 0
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114635 50490699 1 ClO4N5C32H36 AB4C5D32E36 -138.28 8.82 -8.64 -0.48 0
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114636 50490700 1 ClN5O5C32H36 AB5C5D32E36 -169.69 7.25 -8.63 -0.31 0
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114637 50490701 1 O5N6C36H44 A5B6C36D44 -177.0 5.84 -8.68 -0.44 0
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114638 50490702 1 O5N6C39H48 A5B6C39D48 -186.54 7.45 -8.64 -0.37 0
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114639 50490703 1 O5N6C36H44 A5B6C36D44 -178.93 11.45 -8.64 -0.53 0
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114640 50490704 1 O5N6C37H46 A5B6C37D46 -188.31 5.19 -8.74 -0.86 0
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114641 50490705 1 O5N6C37H44 A5B6C37D44 -170.97 4.33 -8.82 -0.36 0
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114642 50490706 1 O5N6C38H46 A5B6C38D46 -179.0 5.58 -8.85 -0.68 0
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114643 50490707 1 O5N6C39H48 A5B6C39D48 -186.52 4.57 -8.66 -0.42 0
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114644 50490708 1 N6O6C37H44 A6B6C37D44 -204.18 4.98 -8.59 -0.62 0
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114645 50490709 1 O5N6C38H46 A5B6C38D46 -183.92 2.65 -8.72 -0.37 0
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114646 50490710 1 O5N6C39H48 A5B6C39D48 -192.74 6.6 -8.81 -0.57 0
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114647 50490711 1 O5N6C40H50 A5B6C40D50 -198.81 5.16 -8.65 -0.42 0
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114648 50490712 1 O5N6C37H46 A5B6C37D46 -188.46 7.82 -8.62 -0.5 0
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114649 50490713 1 ClO5N6C38H39 AB5C6D38E39 -148.76 4.32 -8.79 -1.07 0