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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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91119 49973422 2 N3O3C16H20 A3B3C16D20 -226.77 6.81 -9.13 -0.5 0
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91121 49973438 1 ClN6O6C37H47 AB6C6D37E47 -250.51 8.81 -9.1 -0.52 0
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91122 49973451 2 FN3O3C19H21 AB3C3D19E21 -282.65 7.43 -8.99 -0.89 0
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91123 49973452 1 FN6O7C39H45 AB6C7D39E45 -284.19 8.12 -8.77 -0.45 0
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91124 49973459 1 N6O6C39H52 A6B6C39D52 -255.09 8.05 -9.0 -0.48 0
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91125 49973465 2 FN3O3C19H21 AB3C3D19E21 -283.75 5.76 -9.08 -0.75 0
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91126 49973469 2 N3O3C19H22 A3B3C19D22 -192.01 11.86 -8.82 -0.82 0
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91127 49973473 1 N6O7C39H52 A6B7C39D52 -283.17 9.15 -8.68 -0.34 0
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91128 49973474 1 N6O7C36H48 A6B7C36D48 -274.5 11.3 -8.66 -0.32 0
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91129 49973484 1 FN6O6C38H49 AB6C6D38E49 -290.89 11.64 -8.7 -0.23 0
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91130 49973493 1 FN6O7C39H45 AB6C7D39E45 -278.86 5.88 -8.66 -0.4 0
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91131 49973495 1 FN6O6C38H43 AB6C6D38E43 -246.81 4.91 -8.85 -0.77 0
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91132 49973503 1 N6O6C35H46 A6B6C35D46 -234.54 11.43 -8.59 -0.45 0
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91133 49973504 6 NOC6H8 ABC6D8 -247.25 10.25 -9.0 -0.26 0
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91134 49973558 1 N6O6C37H48 A6B6C37D48 -236.95 7.12 -9.05 -0.32 0
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91136 49973565 1 N6O6C37H50 A6B6C37D50 -250.47 8.74 -9.09 -0.64 0
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91137 49973567 1 ClN6O6C34H43 AB6C6D34E43 -245.65 7.8 -8.83 -0.51 0
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91138 49973568 1 ClN6O6C33H41 AB6C6D33E41 -240.63 12.25 -8.87 -0.43 0
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91139 49973569 1 ClN6O6C36H47 AB6C6D36E47 -251.56 6.33 -8.94 -0.52 0
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91140 49973570 1 ClN6O6C38H49 AB6C6D38E49 -254.76 13.53 -8.81 -0.38 0
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91141 49973579 1 ClN6O6C39H47 AB6C6D39E47 -232.89 5.91 -8.82 -0.56 0
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91142 49973580 1 ClN6O6C39H47 AB6C6D39E47 -232.12 4.8 -8.67 -0.32 0
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91143 49973586 1 ClN6O6C38H51 AB6C6D38E51 -269.64 8.99 -8.68 -0.24 0
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91144 49973644 1 N6O6C39H52 A6B6C39D52 -242.91 5.56 -8.98 -0.3 0
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91145 49973660 1 ClN6O6C38H51 AB6C6D38E51 -269.33 6.22 -8.47 -0.38 0