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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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432898 135173035 1 OSN2C8H10 ABC2D8E10 20.8 5.03 -9.49 -0.6 0
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432899 135173036 2 NC5H8 AB5C8 17.52 3.76 -8.83 1.2 0
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432900 135173037 1 OSN2C8H10 ABC2D8E10 21.71 3.96 -9.39 -0.45 0
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432901 135173038 1 IO2F3N3H5C12 AB2C3D3E5F12 -74.29 2.53 -9.6 -1.74 0
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432902 135173039 1 N3H31C46 A3B31C46 232.0 2.74 -8.74 -0.89 0
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432903 135173040 3 NH13C16 AB13C16 250.84 4.64 -8.86 -0.8 0
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432904 135173041 1 ON10H28C29 AB10C28D29 185.86 10.35 -7.97 -2.24 0
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432905 135173042 1 F2O8N9C46H57 A2B8C9D46E57 -389.27 12.76 -9.29 -0.92 1
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432906 135173043 1 Cl2N7C19H24 A2B7C19D24 127.2 10.45 0.0 0.0 0
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432907 135173044 1 N6C19H24 A6B19C24 126.09 6.69 -8.17 -1.01 0
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432908 135173045 1 O2N7C22H27 A2B7C22D27 72.48 7.54 -8.33 -1.1 0
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432909 135173046 1 O8C53H70 A8B53C70 -347.13 6.94 -8.33 0.28 0
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432910 135173047 1 ClNOH18C24 ABCD18E24 56.33 1.86 -9.45 -0.31 0
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432911 135173048 1 ClNH16C24 ABC16D24 105.12 2.83 -9.14 -0.79 0
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432912 135173049 1 ClNH18C24 ABC18D24 101.25 1.07 -8.94 -0.71 0
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432913 135173050 1 ClNOH18C24 ABCD18E24 57.78 2.17 -9.29 -0.3 0
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432914 135173051 1 OF2N8H20C26 AB2C8D20E26 80.34 10.28 -8.85 -2.37 0
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432915 135173052 1 O2N3C18H37 A2B3C18D37 -157.05 2.98 -9.63 1.15 0
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432916 135173053 1 ClNOH18C24 ABCD18E24 56.67 3.31 -9.47 -0.29 0
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432917 135173054 1 FON9C35H38 ABC9D35E38 109.08 9.17 -8.12 -1.3 0
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432918 135173055 1 ClNH18C24 ABC18D24 101.31 4.03 -9.06 -0.71 0
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432919 135173056 1 ClNOH18C24 ABCD18E24 57.95 2.42 -9.31 -0.23 0
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432920 135173057 1 ClNH16C24 ABC16D24 105.9 2.28 -9.08 -0.77 0
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432921 135173058 1 FON8H29C30 ABC8D29E30 116.42 3.7 -8.62 -1.56 0
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432922 135173059 1 N3H35C50 A3B35C50 240.18 1.12 -8.73 -1.02 0
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432923 135173060 1 N4H26C39 A4B26C39 224.61 2.36 -8.99 -1.17 0
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432924 135173061 1 O9C26H36 A9B26C36 -347.61 5.02 -9.19 -1.42 0
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432925 135173062 1 OPN2H41C52 ABC2D41E52 160.83 4.76 -8.9 -1.04 0
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432926 135173063 1 PN2H35C51 AB2C35D51 237.86 2.39 -8.48 -1.14 0
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432927 135173064 2 SO2N3C6H6 AB2C3D6E6 -25.99 5.32 -9.18 -1.39 0
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432928 135173065 1 S2O6N7C11H11 A2B6C7D11E11 -127.63 4.36 -9.22 -1.6 0
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432929 135173066 1 SI4O6H38C45 AB4C6D38E45 -86.71 4.09 -8.97 -1.12 0
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432930 135173067 1 SI4O4H30C33 AB4C4D30E33 -57.39 1.78 -8.91 -1.1 0
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432931 135173068 1 SO5N6H12C14 AB5C6D12E14 -85.07 7.01 -9.49 -1.64 0
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432932 135173069 1 O3N6C17H18 A3B6C17D18 -12.42 3.09 -8.91 -1.14 0
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432933 135173070 1 FON9H28C29 ABC9D28E29 132.56 6.72 -8.64 -1.51 0
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432934 135173071 1 ON2C11H22 AB2C11D22 -60.22 5.48 -8.96 0.74 0
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432935 135173072 1 ON9C26H27 AB9C26D27 158.71 8.32 -7.97 -2.2 0
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432936 135173073 1 FON8H25C28 ABC8D25E28 107.76 8.79 -8.84 -2.38 0
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432937 135173074 1 IN2S2C4H7 AB2C2D4E7 63.96 5.99 -8.22 -2.63 0
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432938 135173075 2 ON2C7H12 AB2C7D12 -22.78 4.22 -8.77 -0.29 0
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432939 135173076 1 S2F6O6C17H22 A2B6C6D17E22 -546.63 6.18 -9.5 -1.66 0
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432940 135173077 1 FON8H25C28 ABC8D25E28 107.58 3.45 -8.78 -2.45 0
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432941 135173078 1 NH27C42 AB27C42 184.19 1.79 -8.68 -0.65 0
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432942 135173079 1 FON7H18C23 ABC7D18E23 133.0 5.63 -8.87 -2.01 0
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432943 135173080 1 ON3C9H13 AB3C9D13 16.95 1.15 -8.92 0.69 0
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432944 135173081 1 ON3C9H13 AB3C9D13 17.13 2.47 -8.96 0.58 0
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432945 135173082 1 NOSC9H11 ABCD9E11 13.65 3.56 -9.01 -0.13 0
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432946 135173083 1 NSO2C9H11 ABC2D9E11 -64.54 6.17 -9.41 -0.4 0
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432947 135173084 1 SO2C9H12 AB2C9D12 -74.25 2.11 -8.97 -0.03 0
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432948 135173085 1 OSN2C8H10 ABC2D8E10 20.41 2.14 -9.41 -0.39 0
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432949 135173086 1 NOSC9H11 ABCD9E11 10.94 4.05 -8.8 -0.57 0
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432950 135173087 1 OSN2C8H10 ABC2D8E10 21.43 3.05 -9.15 -0.44 0
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432951 135173088 1 ClNOH18C24 ABCD18E24 57.31 1.81 -9.36 -0.36 0
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432952 135173089 1 ClNH16C24 ABC16D24 105.92 1.95 -8.91 -0.68 0
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432953 135173090 1 NH25C36 AB25C36 161.28 2.94 -8.91 -0.56 0
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432954 135173091 1 ON10C27H32 AB10C27D32 133.94 3.77 -8.04 -2.3 0
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432955 135173092 1 ON5C23H27 AB5C23D27 62.88 7.33 -8.5 -0.3 0
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432956 135173093 1 ClNOH18C24 ABCD18E24 56.4 1.24 -9.38 -0.33 0
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432957 135173094 1 ClNOH18C24 ABCD18E24 58.98 1.48 -9.3 -0.21 0
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432958 135173095 1 ClNH16C24 ABC16D24 107.4 3.56 -8.83 -0.5 0
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432959 135173096 1 ClNH18C24 ABC18D24 161.14 2.75 -8.19 -1.01 0
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432960 135173097 4 NH9C14 AB9C14 283.77 3.11 -8.45 -1.07 0
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432961 135173098 1 FO2N9C32H34 AB2C9D32E34 64.13 4.65 -8.82 -2.41 0
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432962 135173099 1 ClNH16C24 ABC16D24 107.67 2.56 -9.18 -0.82 0
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432963 135173100 1 ClNOH18C24 ABCD18E24 57.54 2.32 -9.53 -0.37 0
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432964 135173101 2 NH16C24 AB16C24 220.18 4.3 -8.2 -0.55 0
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432965 135173102 1 N3H33C46 A3B33C46 226.82 1.07 -8.54 -0.87 0
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432966 135173103 1 N3H41C48 A3B41C48 244.52 0.73 -8.31 -0.66 0
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432968 135173105 1 N4C5H10 A4B5C10 60.1 2.14 -8.56 0.46 0
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432969 135173106 1 N3C4H11 A3B4C11 55.98 3.37 -9.14 1.49 0
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432970 135173107 1 N5H39C55 A5B39C55 292.13 2.9 -8.44 -0.93 0
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432971 135173108 1 O2C17H18 A2B17C18 -31.77 2.9 -9.05 -0.16 0
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432972 135173109 1 N4H30C45 A4B30C45 247.61 2.47 -8.99 -1.18 0
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432973 135173110 1 SO4N5C12H13 AB4C5D12E13 -65.18 6.85 -9.06 -1.4 0
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432974 135173111 1 SN4O8H26C34 AB4C8D26E34 -141.85 6.57 -9.36 -2.46 0
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432975 135173112 1 SF2O2N9H21C25 AB2C2D9E21F25 44.94 9.2 -8.31 -1.69 0
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432976 135173113 5 NH7C11 AB7C11 299.82 1.53 -8.43 -1.2 0
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432977 135173114 1 NCl2O6C53H85 AB2C6D53E85 -405.61 4.05 -8.42 -0.37 0
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432978 135173115 1 F2O2H12C15 A2B2C12D15 -130.58 4.84 -9.21 -0.5 0
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432979 135173116 1 N2F3O3H13C18 A2B3C3D13E18 -151.02 5.19 -9.71 -1.38 0
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432980 135173117 1 F3N3O4H12C16 A3B3C4D12E16 -178.07 5.75 -9.61 -1.65 0
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432981 135173118 1 ClNH16C24 ABC16D24 106.23 1.37 -9.05 -0.74 0
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432982 135173119 1 O2C15H22 A2B15C22 -104.88 1.96 -9.57 0.14 0
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432983 135173120 2 N2H18C27 A2B18C27 274.37 4.48 -8.21 -1.2 0
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432984 135173121 1 BrN3H20C30 AB3C20D30 156.51 6.3 -8.16 -1.39 0
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432985 135173122 1 O3N5C6H13 A3B5C6D13 -75.85 2.23 -9.83 -0.61 0
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432986 135173123 2 N2H19C28 A2B19C28 282.68 3.31 -8.48 -1.1 0
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432987 135173124 1 OF2N8H26C30 AB2C8D26E30 67.85 10.11 -8.84 -2.4 0
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432988 135173125 1 ClN2H17C22 AB2C17D22 104.13 1.92 -9.22 -0.85 0
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432989 135173126 1 N3H31C46 A3B31C46 232.6 3.98 -9.02 -0.95 0
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432990 135173127 1 ClNH16C24 ABC16D24 105.79 3.27 -9.04 -0.69 0
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432991 135173128 1 SO4N5C12H13 AB4C5D12E13 -69.63 8.75 -9.13 -1.41 0
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432992 135173129 1 O2C9H12 A2B9C12 -40.17 1.4 -8.16 0.27 0
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432993 135173130 1 FON9H20C25 ABC9D20E25 137.44 9.83 -8.98 -2.5 0
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432994 135173131 1 ClNOH18C24 ABCD18E24 56.58 2.68 -9.35 -0.31 0
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432995 135173132 1 SO4N6C12H14 AB4C6D12E14 -86.27 7.7 -9.58 -1.14 0
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432996 135173133 1 BrNH16C18 ABC16D18 70.74 4.29 -8.23 -0.46 0
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432997 135173134 1 NH37C55 AB37C55 245.67 2.01 -8.56 -0.71 0
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432998 135173135 1 FON9H22C27 ABC9D22E27 149.77 10.93 -8.81 -2.43 0