List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
373042 131308983 1 ON3C12H15 AB3C12D15 57.58 2.89 -9.81 -0.55 0
373043 131309006 1 ClO2C8H11 AB2C8D11 -81.61 2.48 -9.74 -0.64 0
373044 131309023 1 BrO2N4H7C9 AB2C4D7E9 13.62 5.03 -10.23 -1.74 0
373045 131309024 1 BrO2N4H7C9 AB2C4D7E9 23.02 4.88 -10.08 -1.82 0
373046 131309059 1 BrON2H7C11 ABC2D7E11 79.29 6.56 -9.94 -1.14 0
373047 131309064 1 BrON2H7C11 ABC2D7E11 44.37 8.47 -8.89 -1.27 0
373048 131309076 1 BrON2H7C11 ABC2D7E11 78.96 2.14 -9.8 -1.28 0
373049 131309085 1 OSN2C12H14 ABC2D12E14 8.63 3.72 -8.33 -0.28 0
373050 131309123 1 BrClNOH11C12 ABCDE11F12 -5.07 4.77 -10.27 -0.91 0
373051 131309132 1 SN3O3C9H9 AB3C3D9E9 -61.6 7.06 -9.69 -1.69 0
373052 131309151 1 FNOC12H12 ABCD12E12 -45.23 4.26 -9.28 -0.38 0
373053 131309177 1 ClNOF3C10H11 ABCD3E10F11 -192.83 4.06 -9.66 -0.64 0
373054 131309189 1 BrSO3H9C11 ABC3D9E11 -83.9 5.65 -8.96 -1.2 0
373055 131309203 1 ClNO4C10H10 ABC4D10E10 -151.59 7.92 -9.19 -0.7 0
373056 131309210 1 BrN2O3H7C10 AB2C3D7E10 -70.88 3.93 -9.54 -1.54 0
373057 131309229 1 FSN2C12H15 ABC2D12E15 -27.79 2.41 -9.17 -0.84 0
373058 131309257 1 SO3H10C11 AB3C10D11 -103.57 3.35 -8.78 -0.9 0
373059 131309265 1 NO3C11H15 AB3C11D15 -111.61 3.12 -9.0 -0.01 0
373060 131309276 1 BrNOH10C11 ABCD10E11 5.65 4.08 -9.18 -0.34 0
373061 131309282 1 SF3N3C9H12 AB3C3D9E12 -146.21 1.97 -8.8 -0.17 0
373062 131309286 1 BrF2O3H7C9 AB2C3D7E9 -186.35 1.97 -9.19 -0.73 0
373063 131309291 1 BrN2O2H9C10 AB2C2D9E10 -30.45 5.75 -10.22 -1.38 0
373064 131309346 1 BrNSO3H6C10 ABCD3E6F10 9.14 2.89 -9.77 -1.96 0
373065 131309369 1 SO2N3C6H13 AB2C3D6E13 -75.24 4.62 -9.32 -0.05 0
373066 131309377 1 SO3H10C11 AB3C10D11 -106.0 4.61 -9.0 -1.15 0
373067 131309380 1 SO3H10C11 AB3C10D11 -103.9 5.95 -9.03 -1.09 0
373068 131309383 4 NC3H3 AB3C3 90.11 1.69 -9.65 -0.65 0
373069 131309386 4 NC3H3 AB3C3 92.54 2.4 -8.66 -0.26 0
373070 131309418 1 BrNSO3H6C10 ABCD3E6F10 11.47 4.35 -9.48 -2.37 0
373071 131309428 1 SO4H8C10 AB4C8D10 -142.02 4.52 -8.98 -1.19 0
373072 131309429 1 SO4H8C10 AB4C8D10 -132.16 4.37 -8.72 -0.74 0
373073 131309463 1 ClSO3H7C10 ABC3D7E10 -104.3 5.65 -9.16 -1.2 0
373074 131309469 1 ClSO3H7C10 ABC3D7E10 -99.05 4.41 -9.1 -1.34 0
373075 131309480 1 NOCl2H9C11 ABC2D9E11 -19.51 6.4 -8.45 -0.42 0
373076 131309483 1 SN2C8H8 AB2C8D8 50.62 2.78 -7.99 -0.01 0
373077 131309503 1 NO4C9H9 AB4C9D9 -52.57 7.54 -9.69 -1.6 0
373078 131309515 1 FO2H7C9 AB2C7D9 -84.27 4.44 -10.01 -1.36 0
373079 131309519 1 IO2F3H8C10 AB2C3D8E10 -203.43 5.08 -9.86 -1.57 0
373080 131309536 1 SO3H10C11 AB3C10D11 -69.64 0.97 -8.68 -1.14 0
373081 131309560 1 N2C11H12 A2B11C12 40.67 3.71 -8.37 0.2 0
373082 131309595 1 BrSO3H9C11 ABC3D9E11 -90.26 1.5 -8.92 -1.11 0
373083 131309616 1 BrSO2C11H11 ABC2D11E11 -34.2 4.27 -8.08 -0.64 0
373084 131309617 1 BrSO2C11H11 ABC2D11E11 -38.6 3.92 -8.4 -0.44 0
373085 131309642 1 FSO2H9C11 ABC2D9E11 -75.78 6.28 -8.63 -1.13 0
373086 131309648 1 FSO2H9C11 ABC2D9E11 -74.27 1.14 -8.74 -1.2 0
373087 131309655 1 FSO2H9C11 ABC2D9E11 -79.37 2.66 -8.8 -1.06 0
373088 131309679 1 BrON2C11H11 ABC2D11E11 -3.39 2.86 -9.11 -0.55 0
373089 131309727 1 NOBr2H5C8 ABC2D5E8 11.47 4.49 -9.84 -1.0 0
373090 131309728 1 NOBr2H5C8 ABC2D5E8 9.36 4.44 -9.75 -0.98 0
373091 131309734 1 N2C9H16 A2B9C16 4.8 2.59 -9.2 1.31 0
373092 131309743 1 N2C9H16 A2B9C16 5.41 4.55 -9.0 1.36 0
373093 131309831 1 ClN4C11H19 AB4C11D19 30.44 5.05 -8.69 0.49 0
373094 131309861 1 N2O3H14C17 A2B3C14D17 -41.45 4.94 -9.19 -0.91 0
373095 131309890 1 ClN2O2F3H6C7 AB2C2D3E6F7 -218.7 4.17 -8.71 -0.74 0
373096 131309898 1 ClON2F3C8H8 ABC2D3E8F8 -194.62 1.53 -9.21 -0.99 0
373097 131309903 1 ClON2F3C8H8 ABC2D3E8F8 -201.48 4.82 -9.22 -0.48 0
373098 131309911 1 BrNF4C10H10 ABC4D10E10 -199.87 2.96 -9.76 -0.62 0
373099 131309936 1 N5H9C11 A5B9C11 102.5 5.05 -9.22 -1.36 0
373100 131309942 1 SN2O3C9H10 AB2C3D9E10 -103.26 2.91 -8.52 -1.19 0
373101 131309948 1 O2N3C11H17 A2B3C11D17 -63.6 2.03 -9.27 -0.5 0
373102 131309951 1 ON2C10H10 AB2C10D10 24.67 2.52 -9.03 -0.38 0
373103 131309983 1 BrNOF2C8H8 ABCD2E8F8 -110.33 1.99 -9.85 -0.85 0
373104 131309985 1 SN2F3C5H5 AB2C3D5E5 -122.09 2.57 -9.87 -0.96 0
373105 131309996 1 OSCl2C11H12 ABC2D11E12 -42.55 2.56 -8.65 -0.88 0
373106 131310001 1 OSCl2C11H12 ABC2D11E12 -42.41 3.41 -8.89 -0.98 0
373107 131310011 1 OSN2C7H8 ABC2D7E8 7.42 3.5 -9.28 -1.33 0
373108 131310084 1 ON5C9H11 AB5C9D11 50.72 2.93 -9.06 -1.58 0
373109 131310106 1 ON2C11H14 AB2C11D14 -4.72 5.03 -9.86 -0.23 0
373110 131310120 1 ClIO2C11H14 ABC2D11E14 -68.2 5.03 -8.87 -0.7 0
373111 131310135 1 BrClO2C16H16 ABC2D16E16 -46.56 2.23 -9.09 -0.38 0
373112 131310146 1 BrClNOH11C12 ABCDE11F12 -17.77 4.33 -9.48 -0.95 0
373113 131310147 2 NOC6H8 ABC6D8 -80.51 4.63 -9.63 -0.42 0
373114 131310156 1 BrClNOH11C12 ABCDE11F12 -5.21 1.14 -10.28 -1.22 0
373115 131310158 1 BrClNOH11C12 ABCDE11F12 -5.08 2.75 -10.39 -1.21 0
373116 131310188 1 BrNOC13H18 ABCD13E18 -44.07 4.66 -9.17 -0.34 0