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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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223123 85334537 1 O12N19C53H89 A12B19C53D89 -520.3 6.78 -8.35 0.03 1
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223124 85334539 1 P3S4N6O20C42H58 A3B4C6D20E42F58 -1021.89 12.36 0.0 0.0 0
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223125 85334542 2 N8O9C25H38 A8B9C25D38 -834.71 6.02 -8.47 -0.04 0
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223126 85334543 1 O13N15C57H87 A13B15C57D87 -574.64 15.68 -9.04 -0.63 0
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223127 85334546 1 N13O20C51H79 A13B20C51D79 -957.69 7.86 -9.57 -0.01 0
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223128 85334548 1 O10N15C61H91 A10B15C61D91 -442.11 10.05 -8.75 -0.34 0
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223129 85334552 1 O12N19C53H103 A12B19C53D103 -624.78 5.66 -9.43 -0.1 0
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223130 85334553 1 FS2O11N12C58H75 AB2C11D12E58F75 -432.48 16.3 -8.7 -0.98 0
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223131 85334557 1 SO15N16C51H92 AB15C16D51E92 -741.89 13.59 -8.98 -0.12 0
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223132 85334558 1 SO16N18C48H86 AB16C18D48E86 -762.45 10.06 -8.99 -0.36 0
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223134 85334563 1 O13N24C48H86 A13B24C48D86 -570.47 6.59 -9.12 -0.36 0
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223135 85334567 1 N16O18C51H86 A16B18C51D86 -861.98 11.63 -9.18 -0.07 0
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223136 85334570 1 N12O14C61H90 A12B14C61D90 -651.74 9.26 -8.78 -0.36 0
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223137 85334571 1 O13N14C60H90 A13B14C60D90 -610.27 5.27 -9.43 0.06 0
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223138 85334575 1 N15O16C55H93 A15B16C55D93 -791.11 6.18 -8.81 -0.05 0
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223139 85334577 1 N8O19C60H84 A8B19C60D84 -864.76 4.38 -8.84 -1.83 0
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223140 85334581 1 SN12O16C56H94 AB12C16D56E94 -803.84 2.87 -9.42 -0.16 0
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223141 85334582 1 SN12O14C59H90 AB12C14D59E90 -660.41 11.32 -8.6 0.27 0
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223142 85334583 1 O16N18C53H82 A16B18C53D82 -694.8 7.31 -8.55 -0.28 0
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223143 85334586 1 ClFN2O17C64H104 ABC2D17E64F104 -912.4 9.83 -8.68 -0.7 0
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223144 85334588 1 N13O17C56H101 A13B17C56D101 -864.82 17.85 -8.19 -1.77 0
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223146 85334591 1 SN14O18C53H78 AB14C18D53E78 -830.64 3.82 -8.76 -0.1 0
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223147 85334592 1 S2N14O16C53H78 A2B14C16D53E78 -722.43 5.32 -8.49 -0.18 0
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223148 85334593 1 SO15N16C54H86 AB15C16D54E86 -680.09 9.1 -9.37 -0.24 0
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223149 85334594 1 S2N13O14C56H89 A2B13C14D56E89 -676.11 13.25 -9.08 -0.29 0
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223150 85334600 1 S2N14O21C47H78 A2B14C21D47E78 -938.96 12.26 -8.85 -0.33 0
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223151 85334601 1 SN12O20C53H82 AB12C20D53E82 -979.49 3.52 -9.33 -0.36 0
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223152 85334603 1 N14O17C58H78 A14B17C58D78 -710.64 9.6 -9.02 -0.9 0
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223153 85334604 1 S2O16N18C49H82 A2B16C18D49E82 -754.03 9.53 -8.9 -0.34 0
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223154 85334606 1 SN14O17C54H96 AB14C17D54E96 -753.16 7.58 -7.84 -1.94 0
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223155 85334607 1 SN16O16C53H96 AB16C16D53E96 -845.71 13.98 -8.53 -0.1 0
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223156 85334608 1 O13N17C59H91 A13B17C59D91 -556.62 5.01 -8.52 -0.17 0
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223157 85334610 1 N13O17C58H97 A13B17C58D97 -678.74 4.04 -7.65 -1.37 0
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223158 85334611 1 N9O19C61H87 A9B19C61D87 -829.77 9.71 -8.88 -1.88 0
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223160 85334614 2 SO7N8C27H46 AB7C8D27E46 -698.85 5.55 -9.12 -0.15 0
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223161 85334615 1 O13N17C60H87 A13B17C60D87 -556.12 4.84 -9.34 -0.15 0
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223162 85334616 1 S3O11N17C54H95 A3B11C17D54E95 -519.81 15.4 -8.59 -0.1 0
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223163 85334617 2 O7N8C30H43 A7B8C30D43 -579.48 6.31 -9.36 -0.31 0
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223164 85334618 1 N15O23C50H79 A15B23C50D79 -1069.72 12.7 -9.38 -0.38 0
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223165 85334626 1 N15O15C59H103 A15B15C59D103 -779.19 4.88 -9.44 0.04 0
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223166 85334627 2 N6O8C31H47 A6B8C31D47 -779.05 13.5 -9.01 -0.04 0
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223167 85334628 1 SN11O18C59H81 AB11C18D59E81 -752.52 2.49 -8.57 -0.17 0
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223168 85334629 1 SO13N17C57H101 AB13C17D57E101 -656.69 21.93 -8.85 0.03 0
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223169 85334632 5 N3O3C12H19 A3B3C12D19 -712.4 3.52 -8.93 -0.32 0
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223170 85334633 1 SN13O21C53H81 AB13C21D53E81 -986.39 5.48 -8.81 -0.29 0
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223171 85334634 1 O16N17C56H101 A16B17C56D101 -838.71 5.58 -9.13 -0.16 0
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223172 85334635 4 N3O3C17H23 A3B3C17D23 -522.14 7.44 -8.25 -0.24 0
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223174 85334637 1 SN11O12C65H111 AB11C12D65E111 -466.53 20.02 -6.98 -1.38 0
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223175 85334638 1 N17O20C52H91 A17B20C52D91 -985.4 14.63 -9.57 -0.4 3
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223177 85334640 1 N8O13C60H76 A8B13C60D76 -423.1 10.98 -7.83 -1.32 0