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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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94429 50000989 1 ClO5N6C41H55 AB5C6D41E55 -243.67 7.12 -8.66 -0.91 0
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94430 50000997 1 ClO5N6C43H53 AB5C6D43E53 -211.57 4.86 -8.4 -0.48 0
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94431 50001007 1 F3O4N5C29H36 A3B4C5D29E36 -295.95 6.96 -8.9 -1.02 0
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94432 50001030 1 O5N6C37H52 A5B6C37D52 -231.3 3.57 -8.82 -0.35 0
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94433 50001031 1 O5N6C34H48 A5B6C34D48 -224.31 2.76 -8.99 -0.28 0
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94435 50001043 1 FO5N6C37H45 AB5C6D37E45 -241.62 11.85 -8.59 -0.66 0
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94436 50001065 1 FO5N6C38H47 AB5C6D38E47 -242.51 5.39 -8.85 -0.51 0
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94437 50001075 1 O5N6C35H48 A5B6C35D48 -226.88 10.52 -8.69 -0.48 0
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94438 50001168 1 O5N6C31H42 A5B6C31D42 -209.33 5.85 -8.76 -0.55 0
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94439 50001218 1 O5N6C38H48 A5B6C38D48 -196.34 13.4 -8.65 -0.67 0
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94440 50001255 1 O5N6C34H48 A5B6C34D48 -228.1 7.79 -8.9 -0.48 0
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94441 50001278 1 O5N6C35H50 A5B6C35D50 -241.55 5.25 -8.31 -0.47 0
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94442 50001307 1 ClO5N6C36H43 AB5C6D36E43 -188.42 10.68 -8.76 -0.85 0
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94443 50001336 1 O5N6C35H48 A5B6C35D48 -218.22 9.42 -8.87 -0.34 0
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94445 50001431 1 ClO5N6C37H45 AB5C6D37E45 -202.62 8.57 -8.71 -0.59 0
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94446 50001474 1 F2O5N6C37H44 A2B5C6D37E44 -275.63 2.68 -8.97 -0.63 0
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94448 50001481 1 O5N6C38H48 A5B6C38D48 -200.84 7.59 -8.48 -0.33 0
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94449 50001482 1 FO5N6C37H45 AB5C6D37E45 -242.56 8.87 -9.07 -0.62 0
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94450 50001519 1 ClO5N6C33H45 AB5C6D33E45 -236.58 7.83 -8.74 -0.94 0
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94451 50001549 1 FO4N5C30H40 AB4C5D30E40 -220.88 7.04 -8.41 -0.41 0
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94452 50001599 1 O5N6C38H48 A5B6C38D48 -200.45 7.14 -8.19 -0.15 0
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94453 50001616 1 ClO5N6C36H49 AB5C6D36E49 -232.91 3.7 -8.87 -0.57 0
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94454 50001631 1 O4N5C32H45 A4B5C32D45 -181.1 10.8 -8.77 -0.19 0
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94455 50001644 1 N6O6C37H46 A6B6C37D46 -225.26 6.07 -8.65 -0.39 0
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94456 50001656 1 O5N6C34H48 A5B6C34D48 -226.97 9.4 -8.88 -0.39 0