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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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176627 76075544 1 FN3O4C21H22 AB3C4D21E22 -160.26 9.97 -9.6 -1.28 0
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176628 76075545 1 ON4C12H16 AB4C12D16 38.1 7.74 -8.11 -0.32 0
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176629 76075881 1 O2N3C10H17 A2B3C10D17 -18.95 4.45 -9.79 -0.12 0
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176630 76075903 1 SN7O7C36H45 AB7C7D36E45 -216.75 5.53 -8.89 -1.43 0
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176631 76075910 1 N3O8C41H51 A3B8C41D51 -285.22 2.9 -8.54 -0.23 0
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176632 76075911 2 O2C13H18 A2B13C18 -143.07 4.39 -9.17 1.22 0
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176633 76075912 1 ON7C27H31 AB7C27D31 104.42 10.12 -8.32 -0.91 0
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176634 76075913 1 NSO3C9H9 ABC3D9E9 -68.77 5.93 -9.68 -1.05 0
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176635 76076112 1 NO6C12H21 AB6C12D21 -282.49 3.84 -9.78 -0.47 0
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176636 76076113 1 BrNSO3C16H24 ABCD3E16F24 -129.74 5.14 -9.16 -0.18 0
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176637 76076114 1 NO3C26H27 AB3C26D27 -69.44 5.56 -8.55 -0.31 0
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176638 76076257 1 SN4O4C14H18 AB4C4D14E18 -92.03 7.16 -8.88 -1.76 0
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176639 76076258 1 ClFN2O7C33H36 ABC2D7E33F36 -271.2 7.06 -8.71 -0.39 1
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176640 76076259 1 O3N8C27H29 A3B8C27D29 42.75 6.34 0.0 0.0 0
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176641 76077024 2 O4C24H25 A4B24C25 -187.35 4.3 -8.73 -0.12 0
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176642 76078674 1 N5O7C43H55 A5B7C43D55 -276.63 11.86 -9.17 -0.79 0
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176643 76078675 1 S2N4O14C35H38 A2B4C14D35E38 -491.48 5.15 -9.27 -0.62 0
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176644 76078942 1 SO4C6H12 AB4C6D12 -183.72 2.84 -9.2 -0.34 0
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176645 76078943 1 ClN3O4C32H38 AB3C4D32E38 -99.33 3.28 -8.83 -0.38 0
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176646 76079118 2 N2O2C6H7 A2B2C6D7 -69.95 9.7 -9.57 -1.3 0
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176647 76079391 1 BrN2O2C17H17 AB2C2D17E17 -30.43 2.64 -9.62 -1.18 0
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176648 76079392 1 ClN2O2C17H17 AB2C2D17E17 -10.69 1.98 -8.45 -0.45 1
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176649 76079393 1 O2S2C6N6H9 A2B2C6D6E9 24.39 7.8 0.0 0.0 0
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176650 76079394 1 NSO2C10H19 ABC2D10E19 -127.42 3.8 -9.07 0.34 0
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176651 76079395 1 S4O5N7C20H21 A4B5C7D20E21 -29.95 5.42 -8.78 -1.28 0