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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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112417 50406387 1 FO5N6C37H45 AB5C6D37E45 -225.68 4.51 -9.28 -0.46 0
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112418 50406403 1 F2O5N6C36H42 A2B5C6D36E42 -272.55 3.56 -8.86 -0.37 0
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112419 50406473 1 N6O6C33H46 A6B6C33D46 -243.98 6.99 -8.48 -0.48 0
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112420 50406537 1 ClO5N6C36H43 AB5C6D36E43 -188.93 5.34 -8.68 -0.63 0
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112421 50406564 1 O5N6C36H50 A5B6C36D50 -224.43 1.99 -8.88 -0.35 0
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112422 50406565 1 O5N6C33H46 A5B6C33D46 -212.08 9.84 -8.99 -0.82 0
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112423 50406595 1 FN6O6C37H45 AB6C6D37E45 -239.93 9.71 -9.24 -0.85 0
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112424 50406596 1 FN6O6C37H45 AB6C6D37E45 -258.7 5.02 -8.31 -0.6 0
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112425 50406597 2 N3O3C17H24 A3B3C17D24 -222.84 9.95 -8.8 -0.7 0
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112426 50406635 1 FO5N6C40H49 AB5C6D40E49 -229.56 3.63 -8.91 -0.53 0
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112427 50406653 1 ClO5N6C33H45 AB5C6D33E45 -230.86 7.58 -9.06 -1.03 0
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112428 50406659 1 ClO5N6C32H43 AB5C6D32E43 -226.78 11.43 -8.74 -1.07 0
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112429 50406660 1 ClO5N6C35H47 AB5C6D35E47 -225.41 8.62 -9.08 -0.93 0
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112430 50406711 1 O4N5C31H43 A4B5C31D43 -174.55 6.82 -8.32 -0.4 0
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112431 50406712 1 F2O4N5C30H39 A2B4C5D30E39 -253.51 6.92 -8.75 -0.68 0
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112432 50406792 1 F2O5N6C36H42 A2B5C6D36E42 -271.76 4.19 -8.76 -0.83 0
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112433 50406793 1 O5N6C35H48 A5B6C35D48 -211.07 9.73 -8.79 -0.31 0
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112434 50406794 1 O5N6C36H50 A5B6C36D50 -208.94 6.56 -9.08 -0.82 0
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112435 50406795 2 N3O3C17H23 A3B3C17D23 -230.86 9.23 -9.0 -0.82 0
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112436 50406894 1 F2O5N6C36H42 A2B5C6D36E42 -268.65 5.34 -8.85 -0.49 0
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112437 50406998 1 ClO4N5C29H38 AB4C5D29E38 -175.9 6.08 -8.7 -0.42 0
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112438 50407087 1 FO5N6C42H51 AB5C6D42E51 -232.78 4.04 -8.83 -0.55 0
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112439 50407123 1 O5N6C35H42 A5B6C35D42 -172.34 4.83 -8.76 -0.44 0
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112440 50407279 1 F2O5N6C37H44 A2B5C6D37E44 -266.35 4.42 -8.76 -0.83 0
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112441 50407393 1 N6O6C35H48 A6B6C35D48 -247.12 9.91 -8.87 -0.39 0