List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
91013 49972818 1 O5N6C36H50 A5B6C36D50 -225.94 4.55 -8.36 -0.14 0
91014 49972819 1 O5N6C35H48 A5B6C35D48 -218.19 9.88 -8.54 -0.25 0
91015 49972820 1 ClO5N6C39H47 AB5C6D39E47 -182.74 9.72 -8.37 -0.66 0
91016 49972821 1 O5N6C37H52 A5B6C37D52 -235.25 4.92 -8.24 -0.26 0
91017 49972822 1 FO5N6C40H49 AB5C6D40E49 -239.39 7.46 -8.45 -0.44 0
91018 49972843 1 F2O5N6C40H48 A2B5C6D40E48 -283.56 5.84 -9.07 -0.57 0
91019 49972846 1 ClO5N6C33H43 AB5C6D33E43 -219.69 10.66 -8.93 -0.72 0
91020 49972848 1 ClO5N6C36H49 AB5C6D36E49 -227.18 6.29 -8.85 -0.75 0
91021 49972851 1 ClO5N6C37H51 AB5C6D37E51 -233.28 8.38 -8.88 -0.84 0
91022 49972852 1 ClO5N6C37H49 AB5C6D37E49 -221.57 5.15 -8.91 -0.43 0
91023 49972857 1 O5N6C41H52 A5B6C41D52 -199.01 3.4 -8.24 -0.25 0
91024 49972858 1 O5N6C41H52 A5B6C41D52 -196.03 8.1 -8.55 -0.52 0
91025 49972863 1 FO5N6C40H49 AB5C6D40E49 -235.05 5.98 -8.35 -0.63 0
91026 49972877 1 FO4N5C33H44 AB4C5D33E44 -220.78 5.98 -8.88 -0.45 0
91027 49972880 1 SO4N7C29H41 AB4C7D29E41 -150.55 5.66 -9.06 -0.46 0
91028 49972881 1 N5O6C34H47 A5B6C34D47 -247.73 5.22 -8.22 -0.14 0
91029 49972882 1 SO4N7C31H45 AB4C7D31E45 -157.91 10.66 -9.22 -0.46 0
91030 49972893 1 ClO5N6C33H43 AB5C6D33E43 -211.49 3.95 -8.94 -0.88 0
91031 49972898 1 O5N6C37H52 A5B6C37D52 -234.1 4.47 -8.2 -0.14 0
91032 49972899 1 O5N6C36H50 A5B6C36D50 -226.65 9.97 -8.86 -0.42 0
91033 49972905 2 N3O3C20H25 A3B3C20D25 -225.81 5.36 -8.51 -0.27 0
91034 49972906 1 FO5N6C39H47 AB5C6D39E47 -228.7 10.85 -8.74 -0.66 0
91035 49972909 1 ClF3O4N5C33H41 AB3C4D5E33F41 -331.73 6.45 -8.85 -0.9 0
91036 49972924 1 O4N5C34H47 A4B5C34D47 -185.01 11.0 -8.79 -0.07 0
91037 49972926 1 O4N5C34H47 A4B5C34D47 -174.63 8.32 -8.91 -0.14 0
91038 49972930 1 F3O4N5C32H40 A3B4C5D32E40 -296.6 7.04 -9.01 -0.93 0
91039 49972939 1 ClN6O6C37H49 AB6C6D37E49 -256.91 2.93 -8.91 -0.4 0
91041 49972941 1 ClO5N6C39H53 AB5C6D39E53 -236.27 9.77 -8.95 -0.41 0
91042 49972942 1 ClO5N6C37H51 AB5C6D37E51 -233.12 8.33 -9.11 -0.56 0
91043 49972949 1 FO5N6C39H47 AB5C6D39E47 -228.94 4.95 -8.84 -0.72 0
91044 49972952 2 N3O3C20H25 A3B3C20D25 -223.71 12.61 -8.43 -0.5 0
91045 49972956 1 ClO5N6C39H47 AB5C6D39E47 -195.31 6.43 -8.79 -0.76 0
91046 49972960 1 O5N6C38H52 A5B6C38D52 -220.24 1.49 -8.85 -0.15 0
91047 49972962 1 N6O6C37H50 A6B6C37D50 -242.68 4.43 -8.97 -0.46 0
91048 49972963 1 O5N6C38H52 A5B6C38D52 -222.22 4.33 -8.92 -0.26 0
91049 49972969 1 FO5N6C40H49 AB5C6D40E49 -229.62 3.73 -9.06 -0.7 0
91050 49972974 1 FO4N5C33H44 AB4C5D33E44 -215.54 13.21 -8.68 -0.39 0
91051 49972976 1 FO4N5C33H44 AB4C5D33E44 -223.9 6.58 -8.79 -0.37 0
91052 49972990 1 O5N6C38H52 A5B6C38D52 -215.46 8.87 -8.86 -0.58 0
91053 49973006 1 F2O5N6C39H46 A2B5C6D39E46 -267.36 7.97 -8.99 -1.0 0
91054 49973012 1 FO5N6C39H47 AB5C6D39E47 -229.29 7.65 -8.85 -0.74 0
91055 49973038 1 FO5N6C40H49 AB5C6D40E49 -240.29 10.38 -8.89 -0.95 0
91056 49973045 1 FN6O6C40H49 AB6C6D40E49 -259.19 13.12 -8.54 -0.72 0
91057 49973046 1 N6O6C41H52 A6B6C41D52 -224.29 13.88 -8.49 -0.34 0
91058 49973048 1 N6O6C41H52 A6B6C41D52 -230.52 7.92 -8.2 -0.28 0
91059 49973055 1 O5N6C33H44 A5B6C33D44 -207.15 4.89 -9.24 -0.48 0
91060 49973056 1 O5N6C35H48 A5B6C35D48 -204.01 3.17 -9.07 -0.48 0
91062 49973060 1 O5N6C37H52 A5B6C37D52 -224.61 8.55 -9.09 -0.52 0
91063 49973064 1 N6O6C37H50 A6B6C37D50 -245.23 7.56 -8.9 -0.77 0
91064 49973073 1 FO5N6C40H49 AB5C6D40E49 -236.82 6.14 -8.8 -0.49 0
91065 49973074 1 O5N6C40H50 A5B6C40D50 -185.01 7.53 -8.8 -0.48 0
91066 49973091 2 N3O3C19H27 A3B3C19D27 -273.27 10.95 -8.65 -0.35 0
91067 49973104 1 O5N6C37H52 A5B6C37D52 -225.83 5.81 -8.58 -0.4 0
91069 49973112 1 F2O5N6C39H46 A2B5C6D39E46 -273.49 10.21 -8.8 -0.96 0
91070 49973115 1 O5N6C33H44 A5B6C33D44 -209.73 8.63 -9.03 -0.38 0
91071 49973121 1 O5N6C37H50 A5B6C37D50 -213.36 11.08 -8.83 -0.39 0
91072 49973122 1 O5N6C38H52 A5B6C38D52 -213.72 7.14 -8.75 -0.68 0
91073 49973137 1 ClO5N6C40H49 AB5C6D40E49 -193.0 8.79 -8.84 -1.09 0
91074 49973160 1 O5N6C40H56 A5B6C40D56 -228.49 12.57 -8.98 -0.33 0
91075 49973161 1 O5N6C37H52 A5B6C37D52 -229.07 11.48 -8.97 -0.22 0
91076 49973167 1 FO5N6C40H49 AB5C6D40E49 -232.28 8.81 -8.91 -0.58 0
91077 49973168 1 F2O5N6C39H46 A2B5C6D39E46 -271.4 6.21 -9.08 -0.67 0
91078 49973169 1 F2O5N6C39H46 A2B5C6D39E46 -269.32 9.42 -8.74 -0.69 0
91079 49973170 1 FO5N6C40H49 AB5C6D40E49 -237.38 8.23 -8.81 -0.81 0
91081 49973172 1 F2O5N6C39H46 A2B5C6D39E46 -275.82 9.99 -8.93 -0.5 0
91082 49973173 1 O5N6C39H48 A5B6C39D48 -179.23 6.4 -8.85 -0.73 0
91083 49973174 2 N3O3C17H23 A3B3C17D23 -245.81 4.12 -9.01 -0.57 0
91084 49973187 1 FO5N6C40H49 AB5C6D40E49 -229.71 6.29 -8.68 -0.42 0
91087 49973198 1 SO4N6C26H36 AB4C6D26E36 -125.95 9.14 -8.89 -1.36 0
91088 49973218 1 SO4N6C25H34 AB4C6D25E34 -127.14 10.22 -8.75 -0.37 0
91089 49973227 1 ClN4O5C28H35 AB4C5D28E35 -186.55 6.0 -8.76 -0.37 0
91090 49973229 1 BrN4O4C29H37 AB4C4D29E37 -154.65 7.79 -8.68 -0.01 0
91091 49973235 1 ClN4O4C27H33 AB4C4D27E33 -144.87 8.71 -8.99 -0.68 0
91092 49973244 4 NOC7H9 ABC7D9 -144.43 5.29 -8.7 -0.28 0
91093 49973258 1 F3N4O4C28H33 A3B4C4D28E33 -302.9 8.89 -9.07 -0.82 0
91094 49973260 1 N6O6C39H46 A6B6C39D46 -206.45 9.42 -8.82 -0.4 0
91095 49973268 1 ClN6O6C38H43 AB6C6D38E43 -208.07 11.33 -8.65 -0.71 0
91096 49973276 1 N5O6C33H41 A5B6C33D41 -215.98 5.8 -9.12 -0.64 0
91097 49973279 1 F2N5O5C31H37 A2B5C5D31E37 -271.14 10.98 -8.76 -0.73 0
91098 49973280 1 F2N5O5C31H37 A2B5C5D31E37 -268.05 3.59 -9.2 -0.45 0
91099 49973282 1 FN5O5C32H40 AB5C5D32E40 -237.11 9.23 -9.01 -0.34 0
91100 49973287 1 ClN6O6C36H47 AB6C6D36E47 -243.76 12.37 -8.97 -0.6 0
91101 49973290 1 ClN6O6C38H49 AB6C6D38E49 -250.86 5.47 -9.15 -0.5 0
91102 49973300 1 FN6O6C39H45 AB6C6D39E45 -255.74 8.26 -8.74 -0.34 0
91103 49973304 1 N6O7C40H48 A6B7C40D48 -249.04 11.63 -8.85 -0.4 0
91104 49973306 1 N6O7C39H46 A6B7C39D46 -232.99 6.14 -8.13 -0.31 0
91105 49973338 1 N6O7C39H52 A6B7C39D52 -288.02 12.75 -7.72 -0.48 0
91106 49973341 1 N6O7C40H48 A6B7C40D48 -246.13 13.13 -8.62 -0.47 0
91107 49973342 1 N6O7C40H48 A6B7C40D48 -242.91 8.63 -8.36 -0.38 0
91108 49973347 1 N5O5C29H37 A5B5C29D37 -188.32 12.07 -8.5 -0.24 0
91109 49973353 2 N3O3C19H25 A3B3C19D25 -242.01 3.19 -9.16 -0.44 0
91110 49973371 2 N3O3C19H22 A3B3C19D22 -198.89 9.02 -8.97 -0.87 0
91111 49973377 1 FN6O6C39H45 AB6C6D39E45 -251.73 10.64 -8.55 -0.78 0
91112 49973391 1 FN6O6C39H45 AB6C6D39E45 -254.06 3.14 -8.76 -0.43 0
91113 49973394 2 FN3O3C19H21 AB3C3D19E21 -290.31 9.2 -9.08 -0.82 0
91114 49973399 1 FN6O6C38H43 AB6C6D38E43 -249.33 6.4 -8.97 -0.64 0
91115 49973403 1 ClN6O6C32H39 AB6C6D32E39 -232.39 8.96 -8.96 -0.86 0
91116 49973404 1 ClN6O6C34H43 AB6C6D34E43 -234.44 5.62 -9.08 -0.58 0
91117 49973410 1 N6O7C40H48 A6B7C40D48 -243.45 16.5 -8.44 -0.72 0
91118 49973417 1 FN6O6C40H47 AB6C6D40E47 -263.25 8.02 -8.54 -0.47 0