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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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169116 75067067 1 Si3N6O6C36H62 A3B6C6D36E62 -301.95 4.57 -8.77 -0.78 0
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169117 75067068 2 NO6C25H26 AB6C25D26 -414.56 3.54 -8.37 -1.36 0
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169118 75067069 1 N3O3H13C14 A3B3C13D14 -10.14 1.49 -8.7 -0.75 0
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169119 75067070 1 O7C27H40 A7B27C40 -268.78 6.93 -9.41 -0.3 0
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169120 75067421 1 Cl2F2O6N7C39H51 A2B2C6D7E39F51 -341.59 11.67 -8.34 -1.15 0
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169121 75067503 2 N4O4C19H29 A4B4C19D29 -349.83 8.55 -9.4 -1.64 0
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169122 75067515 1 N2O15H38C46 A2B15C38D46 -456.65 6.82 -8.95 -2.03 0
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169123 75067516 1 N12O16C45H66 A12B16C45D66 -713.43 6.6 -8.83 -0.06 0
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169124 75067517 1 N12O17C43H66 A12B17C43D66 -788.24 13.08 -8.94 -0.25 1
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169125 75067518 1 NaN2O4C20H22 AB2C4D20E22 -105.75 11.79 0.0 0.0 0
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169126 75067538 1 ClN4O4C22H25 AB4C4D22E25 -75.01 4.91 -8.38 -1.39 0
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169127 75067539 2 N2O2C11H12 A2B2C11D12 -35.06 3.39 -8.56 -1.3 0
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169128 75067874 1 N9O13C40H63 A9B13C40D63 -638.25 8.8 -9.06 -0.18 0
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169129 75067875 1 ClO2N3C20H26 AB2C3D20E26 -37.4 4.4 -8.88 0.22 0
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169130 75067876 1 O2N3C26H31 A2B3C26D31 -8.18 4.1 -8.6 0.18 0
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169131 75067877 1 ClF3N3O3C23H23 AB3C3D3E23F23 -214.87 1.41 -9.57 -1.38 0
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169132 75067878 1 F3N3O3H22C23 A3B3C3D22E23 -174.29 6.42 -9.6 -1.27 0
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169133 75067879 1 ClF3N3O3C23H23 AB3C3D3E23F23 -218.27 5.1 -9.58 -1.47 0
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169134 75067880 1 F3N3O3H22C23 A3B3C3D22E23 -177.5 2.13 -9.63 -1.32 0
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169135 75067881 1 ClF3N3O3C23H23 AB3C3D3E23F23 -218.42 5.72 -9.8 -1.57 0
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169136 75067882 1 F3N3O3H22C23 A3B3C3D22E23 -177.8 4.38 -9.68 -1.38 0
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169137 75067883 1 ClN2O3C23H23 AB2C3D23E23 -44.46 7.14 -9.61 -1.15 0
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169138 75067884 1 N2O3H22C23 A2B3C22D23 -4.8 5.36 -9.49 -1.08 0
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169139 75067885 1 N5C23H23 A5B23C23 132.64 4.74 -9.13 -0.77 0
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169140 75067886 2 N2C11H11 A2B11C11 110.03 3.81 -9.09 -0.72 0
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169141 75067887 1 ClFN2O2C24H24 ABC2D2E24F24 -38.78 8.03 -9.23 -1.32 0
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169142 75067888 1 ClN2O2C24H27 AB2C2D24E27 -21.62 9.54 -9.06 -1.17 0
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169143 75067889 1 ClN2O2C27H41 AB2C2D27E41 -139.59 4.35 -9.04 0.32 0
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169144 75067890 1 ClN2O3C25H29 AB2C3D25E29 -70.02 7.0 -9.04 -1.79 0
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169145 75067891 1 SN2O6C24H24 AB2C6D24E24 -147.49 7.84 -8.68 -0.77 0
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169146 75067892 1 O3N4C20H26 A3B4C20D26 -62.31 5.55 -8.28 -0.62 0
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169147 75067893 1 NO5C21H25 AB5C21D25 -135.85 1.32 -8.7 -0.08 0
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169148 75067894 2 NO2H10C11 AB2C10D11 -56.73 6.01 -8.36 -0.7 0
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169149 75068004 1 N3C19H21 A3B19C21 75.0 2.42 -9.01 -0.74 0
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169150 75068300 1 BrO2N3C31H40 AB2C3D31E40 -49.58 11.52 -7.85 -0.08 1
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169151 75068301 1 O2N3C31H40 A2B3C31D40 -11.4 3.26 0.0 0.0 0
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169152 75068302 1 BrN3O3C31H38 AB3C3D31E38 -63.53 5.76 -8.2 -0.25 1
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169153 75068303 1 N3O3C31H38 A3B3C31D38 -38.66 4.68 0.0 0.0 0
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169154 75068304 1 ClN3O3C31H38 AB3C3D31E38 -52.55 5.08 -8.24 -0.36 1
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169155 75068305 1 N3O3C31H38 A3B3C31D38 -8.61 7.33 0.0 0.0 0
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169156 75068341 1 OF4N5H25C26 AB4C5D25E26 -71.01 4.82 -8.98 -0.61 0
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169157 75068622 1 O4C29H50 A4B29C50 -219.5 4.9 -9.2 1.39 0
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169158 75068623 1 SN3O3C22H27 AB3C3D22E27 -57.41 6.86 -9.03 -0.28 0
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169159 75068657 1 Si2O5C40H62 A2B5C40D62 -281.0 4.51 -8.82 0.11 0
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169160 75068667 1 NO3H13C15 AB3C13D15 -65.71 14.03 -9.12 -1.44 0
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169161 75068831 2 NO16C25H40 AB16C25D40 -1420.18 5.02 -9.79 -0.35 0
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169162 75068832 2 NO16C24H37 AB16C24D37 -1390.45 6.16 -9.87 -0.52 0
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169163 75068859 1 N2O47H136C148 A2B47C136D148 -1545.55 8.65 -9.44 -0.99 0
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169164 75068860 2 NO24H66C73 AB24C66D73 -1485.31 20.42 -5.98 -2.78 0
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169165 75069383 1 O7C27H40 A7B27C40 -240.54 2.11 -8.39 -0.94 0
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169166 75069384 3 OC10H16 AB10C16 -188.58 3.31 -9.24 -0.01 0
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169167 75069624 1 O2N4C39H44 A2B4C39D44 238.74 2.53 -7.94 0.16 0
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169168 75069625 1 ON4C38H42 AB4C38D42 54.94 1.49 -8.18 -0.26 0
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169169 75069905 1 SN5O6C40H57 AB5C6D40E57 -274.31 5.31 -9.07 -0.18 0
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169170 75069906 1 N2S2Cl3O4C11H15 A2B2C3D4E11F15 -187.51 3.8 -10.1 -2.32 0
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169171 75069907 1 S2N3O6C16H19 A2B3C6D16E19 -166.42 6.6 -9.61 -2.16 0
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169172 75069908 1 S2N3O6C16H19 A2B3C6D16E19 -173.45 8.39 -9.22 -1.56 0
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169173 75069909 1 ClON2C25H29 ABC2D25E29 8.3 4.35 -8.96 -0.19 0
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169174 75070042 1 ClN3O6H22C24 AB3C6D22E24 -216.89 5.32 -8.65 -0.85 0
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169175 75070195 1 NSC10H13 ABC10D13 41.09 1.88 -9.08 -0.16 0
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169176 75070196 1 NC17H17 AB17C17 69.57 1.36 -9.14 0.26 0
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169177 75070460 1 O2N5C10H17 A2B5C10D17 49.06 3.78 -8.93 -1.5 0
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169178 75070461 1 N3C4O4H7 A3B4C4D7 4.42 1.76 -9.68 -1.8 0
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169179 75070740 1 PSSeN2F6C21H22 ABCD2E6F21G22 -344.66 8.32 0.0 0.0 1
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169180 75070741 1 SSeN2C21H22 ABC2D21E22 128.17 14.91 -6.16 -1.71 0
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169181 75070921 1 NC20H25 AB20C25 27.91 1.79 -8.67 0.44 0
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169182 75072199 1 O10C41H62 A10B41C62 -464.55 6.82 -9.56 0.01 0
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169183 75072221 1 O14C37H56 A14B37C56 -672.54 1.3 -10.05 -0.63 0
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169184 75072316 1 NO4C24H25 AB4C24D25 -89.84 7.79 -8.66 -0.97 0
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169185 75072317 1 O2C15H18 A2B15C18 9.19 1.61 -9.63 -0.69 0
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169186 75072318 1 O4C27H34 A4B27C34 -157.94 5.49 -8.63 -1.26 0
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169187 75072319 1 O10H22C23 A10B22C23 -380.26 3.47 -9.34 -1.67 0
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169188 75072396 1 FN3O3H18C19 AB3C3D18E19 -43.67 2.61 -8.7 -0.83 0
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169189 75072631 1 O3N5C30H41 A3B5C30D41 -43.88 7.05 -8.87 0.18 0
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169190 75073029 1 ON6C21H22 AB6C21D22 74.85 4.38 -8.5 -1.15 0
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169191 75073555 2 NO2C12H15 AB2C12D15 -58.75 3.81 -8.01 -0.12 0
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169192 75073630 1 SF3N3O3C20H28 AB3C3D3E20F28 -266.02 5.02 -9.05 -0.6 0
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169193 75073631 5 OC2H2 AB2C2 -162.13 4.16 -9.62 -1.73 0
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169194 75073632 1 O5C11H12 A5B11C12 -170.54 4.73 -9.6 -1.68 0
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169195 75073709 1 FSN3O4C20H24 ABC3D4E20F24 -162.35 7.53 -8.99 -1.33 0
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169196 75073710 1 ClSO3N6C28H35 ABC3D6E28F35 -93.89 4.05 -9.02 -0.95 0
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169197 75073711 1 ClSO3N6C30H39 ABC3D6E30F39 -99.8 6.55 -8.94 -0.9 0
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169198 75073712 1 ClSO3N6C28H33 ABC3D6E28F33 -81.75 7.78 -8.83 -1.09 0
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169199 75073838 1 ClSO3N5C25H28 ABC3D5E25F28 -79.39 3.22 -9.05 -0.99 0
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169200 75073840 2 N2O2C9H17 A2B2C9D17 -143.1 3.35 -9.34 0.5 0
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169201 75073841 1 SN4O6C29H34 AB4C6D29E34 -183.85 8.47 -9.43 -1.69 0
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169202 75074160 1 N3F5O7C32H32 A3B5C7D32E32 -421.44 4.65 -9.36 -1.61 0
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169203 75074565 1 O12N19C73H97 A12B19C73D97 -399.99 2.6 -8.73 -0.31 0
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169204 75074875 1 O2N5C27H35 A2B5C27D35 -44.77 6.14 -8.79 -0.8 0
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169205 75074876 1 FO2N5C25H30 AB2C5D25E30 -59.85 3.73 -9.19 -1.38 0
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169206 75074877 1 O3N5C26H33 A3B5C26D33 -56.96 9.12 -9.02 -1.25 0
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169207 75075073 1 OS2N3C13H17 AB2C3D13E17 41.37 2.58 -8.85 -0.37 0
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169208 75075074 2 NOSC9H9 ABCD9E9 33.08 1.06 -8.86 -0.56 0
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169209 75075490 1 O7H16C17 A7B16C17 -194.64 7.11 -9.15 -1.05 0
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169210 75075491 1 FN5O17C57H90 AB5C17D57E90 -825.01 11.4 -8.77 -1.23 0
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169211 75075839 1 NO3C20H23 AB3C20D23 -31.19 7.92 -10.53 -1.26 0
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169212 75076072 1 ClKSN2O7C26H30 ABCD2E7F26G30 -320.64 13.58 -8.18 -0.63 0
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169213 75076275 1 NOSC15H25 ABCD15E25 -35.75 4.61 -8.36 0.03 0
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169214 75076276 1 NO13C60H75 AB13C60D75 -521.51 4.2 -9.44 -0.72 0
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169215 75076277 1 SN23O23C83H111 AB23C23D83E111 -896.7 18.34 -8.81 -0.55 0