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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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135112 51815613 1 SN3O7C26H27 AB3C7D26E27 -147.5 10.92 -9.19 -1.59 0
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135113 51815666 1 N3O7C22H27 A3B7C22D27 -200.02 8.33 -9.38 -1.55 0
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135114 51815968 1 N2O3C19H28 A2B3C19D28 -130.05 4.46 -9.39 -0.28 0
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135115 51815969 1 SN2O5C23H28 AB2C5D23E28 -168.44 6.44 -9.06 -0.5 0
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135116 51815970 1 SN2O5C23H28 AB2C5D23E28 -169.43 7.73 -9.35 -0.39 0
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135117 51815971 1 N2O3C21H30 A2B3C21D30 -121.72 4.16 -8.98 0.16 0
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135118 51815972 1 N2O3C21H30 A2B3C21D30 -129.95 6.66 -9.4 -0.31 0
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135119 51817003 1 ClN2O2C28H39 AB2C2D28E39 -113.32 1.74 -8.9 -0.53 0
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135120 51817004 1 ClN2O2C28H39 AB2C2D28E39 -106.89 6.66 -8.99 -0.45 0
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135121 51817005 1 ClN2O2C24H31 AB2C2D24E31 -85.8 4.61 -8.92 -0.64 0
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135122 51817168 1 ClN2O2C19H27 AB2C2D19E27 -97.0 4.89 -9.28 -0.57 0
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135123 51817577 1 N3O4C24H31 A3B4C24D31 -80.31 1.78 -9.25 -1.74 0
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135124 51817585 1 N3O5C23H29 A3B5C23D29 -108.33 2.07 -9.09 -1.78 0
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135125 51818222 1 SN2O4C24H32 AB2C4D24E32 -155.06 6.78 -9.36 -0.37 0
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135126 51818852 2 NOC16H21 ABC16D21 -64.44 7.59 -8.88 -0.39 0
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135127 51819060 1 N3O5C29H39 A3B5C29D39 -203.34 5.18 -9.12 -0.06 0
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135128 51819281 2 NO2C13H17 AB2C13D17 -153.95 7.13 -8.84 -0.32 0
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135129 51819340 1 N2O3C25H34 A2B3C25D34 -103.28 5.58 -9.3 -0.27 -2
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135130 51819541 1 N2O5C10H12 A2B5C10D12 -142.98 6.82 -8.34 -0.02 -1
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135131 51819570 1 N2S2O3C16H17 A2B2C3D16E17 -58.8 8.31 0.0 0.0 0
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135132 51819583 1 SO3N4C24H24 AB3C4D24E24 -30.14 3.15 -8.43 -1.54 0
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135133 51819821 1 N2O4C25H34 A2B4C25D34 -145.34 6.95 -8.96 -0.05 0
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135134 51819904 1 N2O2C25H40 A2B2C25D40 -133.82 5.89 -9.01 0.15 0
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135135 51820328 2 NOC11H21 ABC11D21 -175.05 3.32 -9.29 0.92 0
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135136 51820395 1 SN2O4C24H40 AB2C4D24E40 -214.85 8.64 -9.59 -0.25 0
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135137 51820409 1 N2O3C26H44 A2B3C26D44 -183.32 2.38 -8.73 0.26 0
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135138 51821650 1 N2O5C24H38 A2B5C24D38 -239.41 4.8 -9.17 -0.24 0
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135139 51822096 1 N2O3C24H40 A2B3C24D40 -163.88 3.92 -8.78 0.21 0
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135140 51822119 2 NOC13H22 ABC13D22 -149.98 2.64 -8.88 0.5 0
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135141 51822839 1 SN2O4C29H42 AB2C4D29E42 -180.05 5.34 -9.04 -0.33 0
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135142 51823006 1 O2N3C28H41 A2B3C28D41 -81.99 4.1 -8.14 0.18 0
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135143 51823690 1 N2O3C27H44 A2B3C27D44 -184.71 2.95 -9.33 -0.75 0
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135144 51823796 1 N2O3C27H36 A2B3C27D36 -115.83 3.95 -8.88 -0.49 0
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135145 51823835 1 ClN3O5C25H30 AB3C5D25E30 -132.71 6.81 -9.52 -1.56 0
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135146 51824692 1 N2S2O5C18H20 A2B2C5D18E20 -180.44 4.26 -8.99 -1.3 0
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135147 51824737 1 ClO3N4C20H25 AB3C4D20E25 -124.74 4.79 -8.69 -0.38 0
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135148 51824738 1 N2O3C24H32 A2B3C24D32 -109.53 2.0 -9.1 -0.28 0
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135149 51824739 1 N2O3C26H38 A2B3C26D38 -124.89 2.05 -9.02 -0.27 0
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135150 51824932 1 ClN2O2C22H33 AB2C2D22E33 -106.47 3.37 -9.39 -0.57 0
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135151 51824988 1 N2O2Cl3C23H27 A2B2C3D23E27 -92.24 4.69 -9.29 -0.47 0
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135152 51824989 1 N2O2Cl3C25H29 A2B2C3D25E29 -92.29 7.31 -9.39 -0.77 0
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135153 51825273 1 SN2O4C23H30 AB2C4D23E30 -140.2 3.64 -8.97 -0.54 0
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135154 51825274 1 N2O2C21H32 A2B2C21D32 -113.74 2.69 -9.28 0.27 0
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135155 51825607 1 N3O8C25H31 A3B8C25D31 -264.92 8.01 -9.48 -1.07 0
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135156 51826062 2 NOC15H20 ABC15D20 -39.56 7.38 -9.18 -0.69 0
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135157 51826067 1 N2O3C25H30 A2B3C25D30 -58.6 5.09 -9.19 -0.49 0
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135158 51826519 1 SN2O5C28H32 AB2C5D28E32 -162.28 7.49 -9.13 -0.62 0
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135159 51826594 1 N2O4C31H34 A2B4C31D34 -128.47 7.18 -8.87 -0.78 0
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135160 51827009 1 SN2O6C24H30 AB2C6D24E30 -213.58 1.6 -8.68 -0.62 0
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135161 51827161 2 ClNOC13H17 ABCD13E17 -98.87 7.1 -9.35 -0.16 0
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135162 51827162 2 ClNOC13H17 ABCD13E17 -100.93 5.26 -9.27 -0.51 0
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135163 51827163 2 ClNOC13H17 ABCD13E17 -88.02 4.66 -9.31 -0.4 0
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135164 51827206 2 ClNO2C14H18 ABC2D14E18 -165.03 7.99 -8.67 -0.22 0
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135165 51827817 1 SN2O4C20H30 AB2C4D20E30 -163.01 1.49 -8.81 -0.22 0
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135166 51827818 1 SN2O4C20H32 AB2C4D20E32 -189.54 3.63 -8.55 0.14 0
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135167 51828161 1 N3O4C26H35 A3B4C26D35 -99.97 8.2 -9.68 -1.28 0
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135168 51828162 1 N3O4C26H35 A3B4C26D35 -99.4 8.05 -9.74 -1.21 0
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135169 51828583 1 N2O3C34H42 A2B3C34D42 -101.63 3.86 -8.82 -0.08 0
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135170 51828584 1 N2O3C32H40 A2B3C32D40 -99.86 4.29 -9.06 -0.04 0
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135171 51828585 1 N2O3C32H40 A2B3C32D40 -99.94 0.77 -8.99 -0.02 0
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135172 51828586 1 N2O4C31H38 A2B4C31D38 -128.98 4.78 -8.94 0.04 0
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135173 51828802 1 N2O2F3C24H29 A2B2C3D24E29 -229.45 4.38 -9.79 -0.68 0
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135174 51828946 2 NOC11H18 ABC11D18 -124.53 3.24 -9.43 0.01 0
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135175 51829103 1 SN2O4C26H34 AB2C4D26E34 -150.13 8.8 -9.14 -0.25 0
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135176 51829484 1 N2O2C19H38 A2B2C19D38 -173.09 3.56 -9.21 0.99 0
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135177 51829715 1 N3O5C21H21 A3B5C21D21 -156.41 4.48 -8.74 -0.22 0
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135178 51830296 1 N2O5C32H38 A2B5C32D38 -183.37 7.97 -9.06 -0.4 0
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135179 51830297 1 N2O5C30H36 A2B5C30D36 -177.41 1.7 -9.34 -0.1 0
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135180 51830553 1 SN2O6C22H28 AB2C6D22E28 -225.93 7.33 -9.26 -0.43 0
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135181 51830554 2 NO2C10H15 AB2C10D15 -189.56 4.27 -8.98 0.02 0
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135182 51830555 2 NO2C10H15 AB2C10D15 -187.59 7.82 -9.32 -0.27 0
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135183 51830567 1 SN2O5C24H32 AB2C5D24E32 -187.48 8.16 -9.2 -0.74 0
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135184 51830568 1 N2O3C22H34 A2B3C22D34 -152.69 3.91 -9.31 0.3 0
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135185 51830624 1 N2O3C19H36 A2B3C19D36 -190.89 6.39 -9.34 0.57 0
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135186 51830750 1 N2O5C19H30 A2B5C19D30 -229.93 4.85 -8.7 -0.08 0
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135187 51831104 1 N3O3C33H37 A3B3C33D37 -80.26 3.57 -8.66 -0.54 0
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135188 51831162 1 SN3O5C28H37 AB3C5D28E37 -182.39 8.91 -9.46 -0.65 0
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135189 51831476 1 SN3O6C23H29 AB3C6D23E29 -208.59 11.06 -9.59 -0.76 0
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135190 51831666 1 N3O4C24H31 A3B4C24D31 -77.49 8.91 -9.65 -1.39 0
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135191 51832345 1 SCl2N2O5C23H28 AB2C2D5E23F28 -192.68 4.02 -9.53 -0.56 0
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135192 51832346 1 Cl2N2O3C21H30 A2B2C3D21E30 -151.72 2.76 -9.3 -0.47 0
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135193 51832347 1 Cl2N2O3C21H30 A2B2C3D21E30 -151.03 1.95 -9.16 -0.85 0
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135194 51832711 1 ClSN3O4C26H28 ABC3D4E26F28 -106.81 7.96 -9.65 -0.89 0
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135195 51833271 1 FN2O3C32H41 AB2C3D32E41 -153.88 4.02 -8.7 -0.61 0
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135196 51833429 1 ClN3O3C21H22 AB3C3D21E22 -101.77 2.55 -9.64 -0.39 0
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135197 51833430 1 ClFN2O2C23H28 ABC2D2E23F28 -124.15 2.81 -9.49 -0.73 0
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135198 51833496 1 N3O5C27H37 A3B5C27D37 -136.53 8.65 -9.44 -1.57 0
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135199 51833497 1 N3O5C27H37 A3B5C27D37 -141.68 3.29 -9.19 -1.72 0
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135200 51833785 1 N3O6C28H37 A3B6C28D37 -155.9 4.79 -8.93 -1.77 0
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135201 51834197 1 O3N5C21H21 A3B5C21D21 -55.8 6.61 -8.7 -0.66 0
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135202 51834198 1 N2O3C23H38 A2B3C23D38 -174.04 2.62 -8.98 0.04 0
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135203 51834199 1 O3N5C21H21 A3B5C21D21 -53.97 4.62 -9.09 -0.72 0
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135204 51834200 1 N2O3C19H30 A2B3C19D30 -143.12 2.41 -8.99 0.14 0
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135205 51834346 1 ClN3O4C19H28 AB3C4D19E28 -119.92 4.85 -9.78 -1.53 0
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135206 51834347 2 NOC9H18 ABC9D18 -163.9 2.2 -9.35 0.82 0
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135207 51834376 1 Cl2N2O2C19H28 A2B2C2D19E28 -122.29 2.4 -9.32 -0.38 0
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135208 51834442 1 ClN2O2C21H31 AB2C2D21E31 -117.29 5.71 -9.35 -0.57 0
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135209 51834443 1 ClN2O2C23H37 AB2C2D23E37 -140.47 3.26 -9.37 -0.21 0
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135210 51834444 1 ClN2O2C23H37 AB2C2D23E37 -140.59 4.08 -9.25 -0.14 0
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135211 51834514 1 N2O3C25H42 A2B3C25D42 -185.58 7.05 -9.03 -0.16 0