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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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219113 85090592 1 SN5O10C22H37 AB5C10D22E37 -468.07 6.13 -8.63 -0.16 0
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219114 85090594 1 NO8C32H37 AB8C32D37 -270.76 6.48 -8.23 -0.24 0
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219115 85090597 1 O3N5C34H37 A3B5C34D37 19.95 7.62 -9.54 -1.01 1
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219116 85090603 1 FN2H17C21 AB2C17D21 98.35 11.94 -6.83 -1.48 -1
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219118 85090605 1 BrPN5O8C19H27 ABC5D8E19F27 -374.11 2.49 -9.33 -0.29 0
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219119 85090615 1 SN5O9C24H31 AB5C9D24E31 -307.16 6.85 -9.19 -1.0 0
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219120 85090616 1 SN3O5C31H39 AB3C5D31E39 -149.47 6.64 -9.13 -1.34 0
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219121 85090617 1 PdCl2O2S2N4C18H20 AB2C2D2E4F18G20 104.3 4.82 -7.69 -2.2 0
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219122 85090619 1 NSiO4C33H63 ABC4D33E63 -305.28 3.89 -8.8 0.53 0
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219123 85090623 1 N2O7C32H42 A2B7C32D42 -264.86 1.08 -8.91 -0.57 0
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219124 85090625 1 N4O7C29H50 A4B7C29D50 -328.86 7.56 -8.72 -0.32 0
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219125 85090642 1 N2O7C32H44 A2B7C32D44 -317.87 1.44 -8.81 0.0 0
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219126 85090656 1 FS2O5N6C24H35 AB2C5D6E24F35 -201.38 10.13 -9.3 -0.06 0
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219127 85090700 1 NSO5C32H65 ABC5D32E65 -368.87 3.95 -10.18 0.0 0
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219128 85090705 1 O7C18H28 A7B18C28 -348.35 8.01 -10.56 0.2 0
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219129 85090713 1 Si2O9C27H52 A2B9C27D52 -564.18 4.67 -9.12 0.69 1
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219130 85090725 1 SN2O2C31H35 AB2C2D31E35 -11.08 4.08 0.0 0.0 0
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219131 85090731 1 N6O9C26H40 A6B9C26D40 -413.45 10.34 -9.31 -0.5 0
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219132 85090741 1 SF3O5C31H41 AB3C5D31E41 -370.22 9.14 -9.77 -0.58 0
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219133 85090776 1 S2O5N6C27H34 A2B5C6D27E34 -124.61 6.25 -8.98 -1.07 0
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219134 85090796 1 ClPN5O5C28H41 ABC5D5E28F41 -262.89 3.74 -9.03 -1.0 0
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219135 85090798 1 O11H30C32 A11B30C32 -331.75 10.6 -8.67 -1.48 0
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219136 85090804 1 N3O6H33C35 A3B6C33D35 -79.64 4.94 -8.74 -1.34 0
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219137 85090809 1 PN4O4F6C25H27 AB4C4D6E25F27 -392.13 22.47 -9.47 -2.98 0
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219138 85090811 1 PN2F3O6C29H32 AB2C3D6E29F32 -381.67 8.61 -9.48 -1.06 0
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219139 85090825 1 N2O7C34H46 A2B7C34D46 -276.1 6.74 -8.81 -0.19 0
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219140 85090835 1 NO12C29H43 AB12C29D43 -543.37 2.95 -8.86 -0.41 0
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219141 85090849 1 N4O9C16H24 A4B9C16D24 -400.77 7.05 -10.4 -0.4 0
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219142 85090870 2 N2O3C17H21 A2B3C17D21 -225.83 4.19 -8.29 -1.13 0
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219143 85090877 1 F3N5O5C30H36 A3B5C5D30E36 -301.45 13.86 -8.52 -1.12 0
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219144 85090885 1 NSSeO7C27H46 ABCD7E27F46 -348.55 6.78 0.0 0.0 0
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219145 85090927 1 ClN2S2O3F6H21C25 AB2C2D3E6F21G25 -374.65 6.9 -9.34 -1.6 0
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219146 85090935 1 O12C31H48 A12B31C48 -572.27 4.42 -10.11 0.68 0
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219147 85090936 1 SN6O6C30H40 AB6C6D30E40 -190.39 7.11 -8.61 -0.42 0
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219148 85090949 1 ClSN4O6H23C31 ABC4D6E23F31 -79.13 3.99 -8.9 -1.31 0
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219149 85090986 3 NO3C11H13 AB3C11D13 -325.1 6.78 -8.8 -1.8 0
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219150 85091007 1 SiN2O4C36H70 AB2C4D36E70 -308.13 3.45 -8.71 0.71 0
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219151 85091023 1 O2N3F6C33H41 A2B3C6D33E41 -377.23 6.85 -8.57 -1.36 0
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219152 85091038 1 SBr2N2O5C25H28 AB2C2D5E25F28 -190.57 6.36 -9.31 -0.9 0
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219153 85091070 1 ClPSiO2C37H62 ABCD2E37F62 -214.28 12.65 -7.75 -0.29 0
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219154 85091091 1 N2O9C34H56 A2B9C34D56 -404.19 4.55 -9.02 0.16 0
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219155 85091098 1 NO11C33H51 AB11C33D51 -484.09 5.81 -10.04 -0.33 0
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219156 85091100 1 BrNPO7C29H53 ABCD7E29F53 -430.16 5.28 -10.15 -0.45 0
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219157 85091105 1 O2N5C40H57 A2B5C40D57 -41.72 6.75 -8.3 -0.09 0
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219158 85091111 1 N2S2O7C33H40 A2B2C7D33E40 -202.41 5.67 -8.82 -0.67 0
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219159 85091112 1 BrClN3O6H27C30 ABC3D6E27F30 -176.45 2.41 -8.45 -1.3 1
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219160 85091116 1 OS2N3H24C27 AB2C3D24E27 97.95 1.95 0.0 0.0 0
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219161 85091120 1 F6O7C32H32 A6B7C32D32 -551.23 4.57 -9.81 -0.48 0
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219162 85091123 1 S2N6O8C27H42 A2B6C8D27E42 -328.48 3.38 -8.71 -0.47 0
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219163 85091137 1 N5O13C27H43 A5B13C27D43 -633.64 6.89 -9.7 0.32 0
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219164 85091143 1 SN2F3O8C30H41 AB2C3D8E30F41 -346.87 3.48 -9.08 -1.46 0
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219165 85091162 1 NPO12C30H52 ABC12D30E52 -601.36 12.84 -9.09 -0.31 0
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219166 85091165 1 N5O9C31H63 A5B9C31D63 -482.94 4.28 -9.43 0.55 0
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219167 85091170 1 F2N3O7C35H39 A2B3C7D35E39 -359.54 8.53 -9.04 -0.63 0
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219168 85091173 1 N3O9C34H57 A3B9C34D57 -469.83 9.7 -9.86 -0.02 0
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219169 85091185 1 BrSiO4C35H61 ABC4D35E61 -338.22 2.21 -8.86 -0.35 0
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219170 85091188 1 N4O9C34H46 A4B9C34D46 -391.16 7.09 -9.64 -0.16 0
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219171 85091197 1 O3N5C40H57 A3B5C40D57 -66.58 6.39 -8.26 -0.1 0
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219172 85091212 1 FNO15C28H50 ABC15D28E50 -773.34 5.44 -9.84 0.43 0
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219173 85091214 1 SN4O10H28C32 AB4C10D28E32 -298.58 5.7 -8.78 -1.64 0
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219174 85091225 1 O10C37H58 A10B37C58 -503.89 3.28 -9.15 0.79 0
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219175 85091243 1 N2Cl3O7H23C33 A2B3C7D23E33 -167.7 1.19 -8.87 -1.1 0
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219176 85091246 1 O15C32H42 A15B32C42 -592.88 7.72 -8.49 -0.38 0
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219177 85091252 1 N7O8C32H57 A7B8C32D57 -426.41 4.2 -9.67 -0.12 0
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219178 85091259 1 SN6O8C32H40 AB6C8D32E40 -307.28 4.2 -8.62 -0.75 0
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219179 85091261 1 O7H40C43 A7B40C43 -165.99 8.71 -9.28 -1.0 0
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219180 85091273 2 BrN2C17H23 AB2C17D23 -30.47 2.94 -7.61 -1.39 0
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219181 85091275 1 PN6O8H31C33 AB6C8D31E33 -252.95 6.32 -9.38 -0.87 0
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219182 85091294 2 N2O4C18H29 A2B4C18D29 -389.09 12.01 -8.48 0.56 0
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219183 85091296 1 SiO5C43H50 AB5C43D50 -122.75 3.06 -8.4 0.0 0
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219184 85091302 1 ClN3F4O6H30C33 AB3C4D6E30F33 -368.22 5.08 -8.85 -1.14 0
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219185 85091320 1 NO6H41C44 AB6C41D44 -113.34 2.05 -8.1 -0.79 0
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219186 85091323 1 NO5C43H69 AB5C43D69 -282.01 4.94 -8.49 -0.36 0
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219187 85091328 1 O2N5C43H63 A2B5C43D63 -53.67 5.02 -8.03 -0.08 0
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219188 85091342 1 ClSN2O4C40H45 ABC2D4E40F45 80.98 12.25 -7.94 -2.31 0