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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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43157 10318954 1 SN2O2C23H34 AB2C2D23E34 -112.04 7.06 -8.82 0.29 0
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43158 10318955 1 SiO2C26H30 AB2C26D30 -56.74 2.06 -9.23 -0.08 0
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43159 10318959 2 SC13H13 AB13C13 121.88 2.91 -8.24 -1.02 0
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43160 10318960 1 FOC27H43 ABC27D43 -158.51 4.16 -9.33 0.4 0
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43161 10318972 1 SO2N3F5H10C16 AB2C3D5E10F16 -227.02 2.85 -10.42 -1.91 0
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43162 10318974 1 OF5N5C17H18 AB5C5D17E18 -212.67 7.82 -9.73 -0.5 0
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43163 10318976 1 NOF6H19C20 ABC6D19E20 -321.09 3.67 -9.37 -1.21 0
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43164 10318979 1 NOC11H17 ABC11D17 -36.05 1.91 -9.02 0.42 0
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43165 10318980 1 NO8C20H21 AB8C20D21 -271.23 5.24 -9.08 -1.25 0
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43166 10318982 1 O3N7H17C20 A3B7C17D20 28.25 5.26 -8.95 -1.05 0
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43167 10318989 1 N3O6C20H25 A3B6C20D25 -211.53 3.25 -9.02 -1.13 0
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43168 10319000 1 NSO5C21H25 ABC5D21E25 -175.66 6.03 -8.39 -0.52 0
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43169 10319003 1 NO5C23H33 AB5C23D33 -250.73 3.6 -9.52 0.06 0
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43170 10319007 1 NS2O5C18H29 AB2C5D18E29 -237.16 5.99 -8.74 -0.28 0
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43171 10319008 1 NS2O5C18H29 AB2C5D18E29 -247.36 8.37 -8.79 -0.22 0
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43172 10319019 1 ClNOC26H26 ABCD26E26 18.32 3.09 -8.77 -0.32 0
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43173 10319020 1 ClNO3C22H42 ABC3D22E42 -231.08 2.63 -9.85 -0.24 0
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43174 10319048 1 OSN6H20C21 ABC6D20E21 75.97 10.5 -8.94 -0.86 0
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43175 10319060 2 N3C12H16 A3B12C16 55.98 4.64 -8.18 -0.34 0
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43176 10319090 1 N3O4C23H23 A3B4C23D23 -64.9 6.08 -8.44 -0.68 0
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43177 10319115 1 O2N3C25H31 A2B3C25D31 -35.99 5.91 -9.19 -0.6 0
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43178 10319139 1 F2N2S2O3H12C18 A2B2C2D3E12F18 -145.64 5.04 -9.36 -1.35 0
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43179 10319144 1 N2O5H22C23 A2B5C22D23 -145.36 5.11 -9.52 -1.11 0
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43180 10319171 2 ON2C12H15 AB2C12D15 -19.84 4.9 -9.29 -0.72 0
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43181 10319195 1 ClO4C23H31 AB4C23D31 -150.74 4.95 -8.41 -0.69 0
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43182 10319205 1 OF4N7H13C17 AB4C7D13E17 -129.15 3.58 -8.64 -1.11 0
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43183 10319210 1 O2F3N5C19H20 A2B3C5D19E20 -197.02 4.25 -8.89 -1.01 0
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43184 10319228 1 NOSF2H19C24 ABCD2E19F24 -45.13 5.91 -8.07 -1.05 0
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43185 10319240 1 SN3O3C21H33 AB3C3D21E33 -132.53 2.23 -8.29 0.08 0
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43186 10319245 1 ClON7H18C20 ABC7D18E20 73.28 3.52 -8.93 -1.12 0
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43187 10319250 1 ClNSO4C20H22 ABCD4E20F22 -149.52 4.43 -9.09 -0.37 0
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43188 10319270 1 FN2O2H17C26 AB2C2D17E26 -14.96 4.36 -8.46 -0.65 0
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43189 10319272 6 OC4H4 AB4C4 -210.71 1.51 -9.65 -1.65 0
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43190 10319289 1 O3N8C18H32 A3B8C18D32 -84.06 3.43 -9.01 -0.59 0
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43191 10319291 1 SN2O5C20H28 AB2C5D20E28 -163.63 5.54 -8.9 -0.54 0
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43192 10319300 1 ClIN2O2H6C15 ABC2D2E6F15 21.69 1.45 -9.52 -2.12 0
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43193 10319334 1 NF2O4C22H29 AB2C4D22E29 -285.72 6.87 -9.39 -0.41 0
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43194 10319340 1 SN3O5C19H27 AB3C5D19E27 -210.28 5.45 -8.93 -0.24 0
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43195 10319353 1 ClFN3O6H13C17 ABC3D6E13F17 -259.13 8.86 -9.45 -1.5 0
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43196 10319427 1 N3O5C22H25 A3B5C22D25 -169.44 6.99 -8.48 -0.33 0
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43197 10319446 1 NO3C26H37 AB3C26D37 -144.83 2.92 -8.68 -0.1 0
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43198 10319454 1 Cl2O2N3H15C21 A2B2C3D15E21 18.36 4.28 -9.57 -1.59 0
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43199 10319455 1 BrNO5C18H22 ABC5D18E22 -206.67 2.21 -9.35 -0.61 0
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43200 10319471 1 N2O4H20C25 A2B4C20D25 -65.71 2.68 -8.68 -1.13 0
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43201 10319483 1 N2O3H24C26 A2B3C24D26 -29.09 8.23 -8.51 -0.51 0
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43202 10319500 1 BrMgNO3H18C19 ABCD3E18F19 -143.79 8.26 -8.75 -0.85 0
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43203 10319506 1 SiO4C24H32 AB4C24D32 -181.68 3.58 -8.97 0.16 0
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43204 10319533 1 OCl2N2H22C23 AB2C2D22E23 -5.22 4.1 -8.72 -0.71 0
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43205 10319534 1 BrO2C23H25 AB2C23D25 -76.21 3.08 -9.12 -0.9 0
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43206 10319552 1 N3O3H23C25 A3B3C23D25 -9.11 3.01 -8.09 -0.7 0
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43207 10319553 1 N3O3H23C25 A3B3C23D25 -25.4 4.43 -8.71 -1.02 0
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43208 10319560 1 OF2N3C24H29 AB2C3D24E29 -82.59 3.29 -8.1 -0.46 0
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43209 10319591 2 N2O4H7C9 A2B4C7D9 -128.41 2.93 -9.63 -2.17 0
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43210 10319607 1 N2O4H22C25 A2B4C22D25 51.87 8.06 -8.92 -1.56 0
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43211 10319620 1 N2O3C26H26 A2B3C26D26 -33.66 5.41 -8.57 -0.54 0
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43212 10319621 1 FSO2N4C21H23 ABC2D4E21F23 -73.71 2.12 -8.7 -0.3 0
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43213 10319649 1 SnC22H32 AB22C32 24.35 0.5 -9.24 0.45 0
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43214 10319676 1 N3O3C25H25 A3B3C25D25 15.49 5.62 -7.92 -0.39 0
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43215 10319693 1 ClO2N5H14C22 AB2C5D14E22 61.42 0.59 -8.93 -1.25 0
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43216 10319719 2 NO3C11H14 AB3C11D14 -220.28 0.87 -8.21 0.03 0
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43217 10319724 1 ON8C22H24 AB8C22D24 101.21 5.74 -9.54 -0.9 0
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43218 10319763 1 O3C27H44 A3B27C44 -179.95 4.75 -8.54 0.53 0
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43219 10319782 1 NO2Cl4H13C18 AB2C4D13E18 -55.93 0.97 -9.28 -2.12 0
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43220 10319827 1 NSF3O4C18H34 ABC3D4E18F34 -369.94 13.74 -10.03 -0.71 1
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43221 10319828 1 NOC17H34 ABC17D34 -67.58 4.01 0.0 0.0 0
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43222 10319837 1 NO2C27H47 AB2C27D47 -166.3 4.32 -8.92 2.56 0
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43223 10319865 1 O3N4C24H26 A3B4C24D26 -28.12 4.8 -8.09 -0.52 0
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43224 10319876 1 O3C28H34 A3B28C34 -71.58 3.99 -8.3 -1.19 0
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43225 10319892 1 ClO2N4H19C23 AB2C4D19E23 11.59 6.47 -8.78 -0.82 0
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43226 10319907 1 SO2F3N5H12C18 AB2C3D5E12F18 -76.48 6.46 -8.94 -1.96 0
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43227 10319929 1 OSN5C23H25 ABC5D23E25 92.32 7.39 -8.48 -0.78 0
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43228 10319936 1 ClON5H22C23 ABC5D22E23 40.98 9.03 -8.31 -1.52 0
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43229 10319979 1 O3C28H36 A3B28C36 -65.86 2.77 -8.47 -0.33 0
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43230 10319992 1 NOBr2C17H27 ABC2D17E27 -47.53 1.81 -9.08 -0.52 0
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43231 10319998 1 N3O3F4H15C20 A3B3C4D15E20 -228.07 13.46 -9.14 -1.29 0