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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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141768 52926138 1 NPO9C43H84 ABC9D43E84 -611.57 4.56 -9.54 -0.02 0
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141769 52926173 1 NPO9C46H92 ABC9D46E92 -646.76 5.71 -9.78 0.11 0
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141770 52926174 1 NPO9C44H78 ABC9D44E78 -515.33 7.21 -9.41 -0.18 0
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141771 52926175 1 NPO9C44H88 ABC9D44E88 -651.18 2.87 -9.73 0.02 0
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141772 52926362 1 PO10C37H71 AB10C37D71 -636.02 4.46 -9.5 0.21 0
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141773 52926555 1 PO10C41H73 AB10C41D73 -531.31 3.39 -8.29 0.11 0
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141774 52926778 1 PO10C41H79 AB10C41D79 -646.35 3.43 -9.24 -0.1 0
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141775 52926779 1 PO10C42H81 AB10C42D81 -651.51 4.89 -9.53 0.02 0
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141776 52927223 1 PO10C42H77 AB10C42D77 -604.96 4.09 -9.22 0.31 0
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141777 52927224 1 PO10C42H81 AB10C42D81 -652.88 4.61 -9.43 0.11 0
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141778 52927265 1 PO9C44H81 AB9C44D81 -551.53 4.51 -9.35 0.34 0
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141779 52927285 1 PO9C45H91 AB9C45D91 -647.52 0.62 -9.7 0.23 0
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141780 52927304 1 PO9C44H81 AB9C44D81 -548.67 0.14 -9.4 0.13 0
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141781 52927305 1 PO9C45H91 AB9C45D91 -641.99 3.47 -10.06 0.26 0
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141782 52927306 1 PO9C45H89 AB9C45D89 -595.74 1.71 -8.77 0.69 0
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141784 52927324 1 PO9C41H83 AB9C41D83 -631.45 7.19 -10.42 0.16 0
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141785 52927408 1 PO9C44H85 AB9C44D85 -576.3 5.75 -9.44 0.14 0
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141786 52927502 1 PO13C40H69 AB13C40D69 -699.48 8.13 -9.21 0.0 0
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141787 52927873 1 PO13C49H85 AB13C49D85 -699.65 11.6 -9.28 -0.12 0
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141788 52927893 1 PO13C48H85 AB13C48D85 -736.63 4.45 -9.38 -0.09 0
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141789 52928178 1 PO13C43H79 AB13C43D79 -763.98 4.74 -9.46 0.2 0
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141790 52928404 1 PO13C53H79 AB13C53D79 -573.36 5.2 -9.35 -0.24 0
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141791 52928417 1 PO12C38H75 AB12C38D75 -734.7 2.53 -10.01 -0.16 0
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141793 52928419 1 PO12C39H75 AB12C39D75 -718.22 8.95 -9.74 -0.22 0
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141794 52928466 1 PO12C47H93 AB12C47D93 -777.35 1.45 -9.75 0.23 0
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141795 52928467 1 PO12C47H91 AB12C47D91 -745.07 5.09 -9.61 -0.24 0
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141796 52928468 1 PO12C47H89 AB12C47D89 -730.02 1.27 -9.46 0.21 0
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141797 52928476 1 PO12C49H93 AB12C49D93 -735.72 6.64 -9.54 0.12 0
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141798 52929026 1 PO8C38H63 AB8C38D63 -434.22 5.38 -9.44 0.43 0
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141799 52929273 1 PO8C40H77 AB8C40D77 -522.36 5.14 -9.57 -0.28 0
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141800 52929487 1 PO8C35H69 AB8C35D69 -561.27 4.35 -10.55 0.45 0
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141802 52930079 1 O17C136H254 A17B136C254 -1236.68 5.18 -10.01 -0.29 0
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141803 52930099 1 O17C136H254 A17B136C254 -1226.14 4.46 -9.72 -0.01 0
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141805 52930862 2 O8C69H128 A8B69C128 -1183.18 5.01 -9.87 -0.41 0
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141806 52931239 1 NPO18C56H110 ABC18D56E110 -1087.91 6.89 -9.99 -0.36 0
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141807 52931462 2 O5C17H29 A5B17C29 -541.31 5.13 -9.99 1.01 0
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141808 52931463 1 O15C40H68 A15B40C68 -739.9 2.51 -10.04 0.61 0
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141809 52931595 1 ClISN2C14H18 ABCD2E14F18 67.38 1.22 -9.01 -0.48 0
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141810 52931667 1 NF3O5H18C21 AB3C5D18E21 -317.56 7.25 -8.94 -1.58 0
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141811 52931857 1 O2N5C30H47 A2B5C30D47 -98.93 6.9 -9.04 -0.35 0
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141812 52931858 1 O2N5C29H43 A2B5C29D43 -78.88 2.92 -8.8 -0.31 2
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141814 52932082 1 O2N3H17C26 A2B3C17D26 166.01 6.02 -7.47 -1.6 0
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141815 52932375 1 SN2O6C22H24 AB2C6D22E24 -200.03 12.91 -9.14 -1.73 0
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141816 52932565 1 OSF2N6H24C29 ABC2D6E24F29 19.92 5.8 -8.86 -0.99 0
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141817 52932584 1 ON5C18H21 AB5C18D21 46.72 1.95 -8.57 -0.61 0
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141818 52932647 1 ON8H34C36 AB8C34D36 135.66 3.15 -8.12 -0.81 0
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141819 52932978 2 NO2C15H20 AB2C15D20 -144.72 5.28 -9.18 -0.09 0
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141820 52933560 1 ClFO2N4H14C21 ABC2D4E14F21 -2.69 0.52 -8.89 -1.18 0
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141821 52933561 1 O2N6H22C23 A2B6C22D23 29.93 1.09 -8.61 -0.8 0
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141822 52933562 1 O2F3N4H17C23 A2B3C4D17E23 -113.86 2.34 -8.88 -1.2 0