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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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95687 50012195 1 F2O5N6C35H40 A2B5C6D35E40 -262.81 8.16 -8.89 -0.64 0
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95688 50012199 2 N3O3C17H23 A3B3C17D23 -243.15 8.17 -8.78 -0.46 0
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95689 50012302 1 O5N6C29H38 A5B6C29D38 -200.48 10.09 -8.87 -0.22 0
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95690 50012309 1 BrFO4N5C27H33 ABC4D5E27F33 -192.02 6.77 -8.9 -0.72 0
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95691 50012381 1 F3O4N5C28H34 A3B4C5D28E34 -313.21 5.16 -8.85 -0.77 0
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95692 50012385 1 FO5N6C35H41 AB5C6D35E41 -221.68 11.27 -8.83 -0.9 0
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95693 50012399 1 ClO5N6C32H43 AB5C6D32E43 -221.18 8.06 -9.0 -0.96 0
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95694 50012454 1 F2O5N6C35H40 A2B5C6D35E40 -264.96 9.83 -8.91 -0.82 0
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95695 50012469 1 FN6O6C35H41 AB6C6D35E41 -255.74 10.51 -8.42 -0.34 0
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95696 50012551 2 N3O3C18H25 A3B3C18D25 -259.06 4.39 -8.36 -0.15 0
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95697 50012693 1 O5N6C33H46 A5B6C33D46 -223.16 6.98 -8.56 -0.1 0
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95698 50012694 1 O5N6C32H44 A5B6C32D44 -214.61 5.86 -8.46 -0.16 0
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95699 50012719 1 ClO5N6C36H49 AB5C6D36E49 -234.12 8.42 -8.94 -0.73 0
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95700 50012724 1 ClO5N6C37H45 AB5C6D37E45 -189.16 10.42 -9.1 -1.08 0
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95701 50012791 2 N3O3C18H26 A3B3C18D26 -268.75 8.77 -8.09 -0.18 0
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95702 50012805 1 N6O6C33H44 A6B6C33D44 -230.85 1.25 -8.95 -0.92 0
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95703 50012825 1 F2O5N6C35H40 A2B5C6D35E40 -253.02 15.95 -8.7 -0.97 0
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95704 50012826 1 FO5N6C36H43 AB5C6D36E43 -223.3 11.56 -8.74 -0.3 0
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95705 50012836 1 FO5N6C30H39 AB5C6D30E39 -246.11 11.66 -8.6 -0.38 0
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95706 50012843 1 O5N6C32H44 A5B6C32D44 -210.05 10.13 -8.86 -0.17 0
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95707 50012844 1 O5N6C35H50 A5B6C35D50 -212.84 13.45 -8.86 -0.88 0
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95708 50012853 1 ClO5N6C36H43 AB5C6D36E43 -185.01 8.47 -8.49 -0.73 0
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95709 50012854 1 O5N6C37H46 A5B6C37D46 -183.53 10.21 -8.52 -0.48 0
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95710 50012856 1 FO5N6C36H43 AB5C6D36E43 -225.07 9.66 -8.38 -0.63 0
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95711 50012858 1 N6O6C37H46 A6B6C37D46 -215.56 8.28 -8.33 -0.42 0