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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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64051 26759772 1 NSO7H15C17 ABC7D15E17 -228.46 4.76 -9.02 -0.8 0
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64052 26759773 2 NSO3C10H12 ABC3D10E12 -212.23 4.48 -9.2 -0.98 0
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64053 29195904 1 O2N3C22H25 A2B3C22D25 -4.37 5.38 -8.47 -0.02 0
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64054 29195906 1 ClSN4O5C22H23 ABC4D5E22F23 -91.4 6.19 -8.77 -1.82 0
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64055 29195907 1 ClNO3C16H20 ABC3D16E20 -111.41 3.15 -9.0 -0.8 0
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64056 29195914 1 FNOSC13H14 ABCDE13F14 -70.22 2.78 -9.13 -1.05 0
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64057 29195917 1 SN3O4C25H37 AB3C4D25E37 -171.61 10.2 -8.77 -0.4 0
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64058 29195920 1 ON3C15H19 AB3C15D19 0.4 3.85 -9.27 -0.78 0
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64059 29195923 1 ON3C15H19 AB3C15D19 -0.11 1.74 -9.3 -0.69 0
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64060 29195926 1 O2N3C22H25 A2B3C22D25 -9.54 6.0 -8.72 -0.12 0
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64061 29195931 1 NOSC17H19 ABCD17E19 -0.08 3.64 -9.0 -1.07 0
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64062 29195948 1 SN3O3C24H29 AB3C3D24E29 -95.17 5.04 -8.46 -0.18 0
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64063 29195970 1 FSN3O3C20H30 ABC3D3E20F30 -168.67 7.39 -8.94 -0.79 0
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64064 29195973 1 ClON3C21H22 ABC3D21E22 14.8 1.59 -8.89 -0.63 0
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64065 29195976 1 ClSN4O4H21C22 ABC4D4E21F22 -27.24 5.46 -8.92 -1.71 0
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64066 29195980 1 FSN3O3C23H32 ABC3D3E23F32 -168.7 6.82 -8.92 -0.58 0
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64067 29195981 1 ClFSO2N4H20C24 ABCD2E4F20G24 -47.07 2.17 -8.86 -0.7 0
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64068 29195982 2 NO2H13C14 AB2C13D14 -54.0 2.41 -8.55 -1.07 0
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64069 29195983 1 FSN3O4C15H22 ABC3D4E15F22 -183.15 2.45 -8.94 -0.8 0
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64070 29195986 2 NOC10H10 ABC10D10 -31.95 4.59 -9.08 -0.37 0
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64071 29195990 1 ClSN3O4C23H24 ABC3D4E23F24 -92.51 4.02 -8.39 -0.88 0
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64072 29195992 1 N2O3C24H28 A2B3C24D28 -84.82 2.02 -8.84 -0.49 0
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64073 29195998 1 ClFSN3O3C16H23 ABCD3E3F16G23 -166.82 3.72 -9.16 -0.94 0
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64074 29196002 1 SCl2N2O3C18H18 AB2C2D3E18F18 -90.85 4.79 -9.56 -1.22 0
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64075 29196017 1 ON3C21H21 AB3C21D21 31.62 3.59 -9.19 -0.45 0
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64076 29196019 1 ON3C22H23 AB3C22D23 26.09 4.22 -9.28 -0.17 0
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64077 29196025 2 NO2C9H11 AB2C9D11 -97.09 6.18 -9.54 -0.41 0
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64078 29196027 1 SN3O4H23C27 AB3C4D23E27 -44.0 6.1 -8.53 -0.75 0
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64079 29196030 1 SN3O3H25C28 AB3C3D25E28 -23.79 5.99 -8.31 -0.28 0
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64080 29196035 1 FSN3O5C21H26 ABC3D5E21F26 -185.12 6.1 -8.5 -0.92 0
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64081 29196038 1 FSN3O5C21H26 ABC3D5E21F26 -196.22 2.11 -9.04 -0.86 0
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64082 29196045 1 FSN3O3H22C24 ABC3D3E22F24 -94.46 4.64 -9.01 -1.12 0
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64083 29196050 1 SN2O5C23H28 AB2C5D23E28 -167.62 8.87 -9.01 -0.76 0
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64084 29196062 1 O2N3C17H17 A2B3C17D17 -40.24 5.17 -9.14 -0.37 0
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64085 29196065 1 ClON3C20H24 ABC3D20E24 -0.03 5.54 -9.12 -0.43 0
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64086 29196067 1 SF3N3O3C19H20 AB3C3D3E19F20 -205.97 9.87 -8.88 -1.08 0
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64087 29196072 1 ON2H20C22 AB2C20D22 46.09 4.04 -9.4 -0.9 0
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64088 29196081 1 BrClFSN3O3C19H20 ABCDE3F3G19H20 -117.88 8.71 -8.91 -1.22 0
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64089 29196088 1 ClSN2O4C18H19 ABC2D4E18F19 -87.98 2.4 -9.41 -1.11 0
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64090 29196092 1 SN3O4C27H27 AB3C4D27E27 -88.1 4.0 -8.61 -0.86 0
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64091 29196096 1 N2O4H16C17 A2B4C16D17 -40.87 8.4 -9.43 -1.35 0
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64092 29196097 1 FSN4O5C20H23 ABC4D5E20F23 -131.48 7.72 -9.11 -1.37 0
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64093 29196102 1 ClFSN4O5C19H20 ABCD4E5F19G20 -123.3 9.07 -9.05 -2.12 0
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64094 29196103 1 O2N3H19C20 A2B3C19D20 20.82 4.69 -9.55 -0.72 0
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64095 29196104 1 SN3O3C27H27 AB3C3D27E27 -58.76 4.94 -8.62 -0.79 0
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64096 29196106 2 NOC8H9 ABC8D9 -20.67 4.78 -9.39 -0.14 0
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64097 29196107 1 SN3O3F4C20H21 AB3C3D4E20F21 -272.42 8.14 -8.86 -0.92 0
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64098 29196116 1 SN2O2H20C21 AB2C2D20E21 -8.9 4.83 -9.18 -0.64 0
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64099 29196117 1 FSN3O3H24C26 ABC3D3E24F26 -97.56 7.14 -8.85 -0.89 0
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64100 29196125 1 FSN3O3C25H26 ABC3D3E25F26 -90.25 1.57 -9.06 -0.89 0
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64101 29196127 1 FNOSH14C18 ABCDE14F18 -26.18 4.28 -9.08 -0.96 0
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64102 29196150 1 FSN3O4C21H26 ABC3D4E21F26 -160.38 4.52 -9.03 -0.88 0
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64103 29196157 1 SN3O3C28H29 AB3C3D28E29 -68.29 4.53 -8.65 -0.94 0
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64104 29196158 1 N2O3C20H24 A2B3C20D24 -106.4 7.18 -8.59 -0.16 0
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64105 29196165 1 FSN3O5C21H26 ABC3D5E21F26 -193.44 4.03 -8.69 -0.78 0
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64106 29196167 1 ClSN2O4C21H23 ABC2D4E21F23 -147.69 4.77 -9.28 -0.79 0
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64107 29196176 1 BrSN2O4C21H23 ABC2D4E21F23 -128.94 5.76 -9.61 -0.68 0
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64108 29196178 1 FSO2N4H21C27 ABC2D4E21F27 -12.01 5.34 -8.41 -0.64 0
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64109 29196181 1 SO2N4H26C29 AB2C4D26E29 17.88 4.88 -8.25 -0.29 0
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64110 29196182 1 SN2O5C22H26 AB2C5D22E26 -172.75 7.46 -9.36 -0.56 0
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64111 29196191 1 SN3O4C20H25 AB3C4D20E25 -160.65 3.88 -9.1 -0.48 0
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64112 29196198 1 FSN3O5C22H28 ABC3D5E22F28 -197.27 4.55 -8.36 -0.78 0
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64113 29196199 1 SN3O3C26H27 AB3C3D26E27 -57.09 5.24 -8.71 -0.97 0
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64114 29196201 1 SN3O3C26H27 AB3C3D26E27 -57.11 3.08 -8.56 -0.85 0
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64115 29196202 1 N2O3C20H30 A2B3C20D30 -130.65 1.92 -8.89 -0.56 0
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64116 29196205 1 N3O4C16H23 A3B4C16D23 -87.5 6.58 -9.14 -1.18 0
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64117 29196222 1 SF2N3O3H23C25 AB2C3D3E23F25 -145.55 2.67 -8.6 -0.92 0
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64118 29196231 1 N3O3C16H25 A3B3C16D25 -62.74 7.93 -8.95 -0.93 0
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64119 29196246 1 ON2C14H18 AB2C14D18 -24.68 2.51 -8.79 -0.49 0
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64120 29196250 1 FS2N3O3C17H20 AB2C3D3E17F20 -108.29 5.31 -8.95 -0.86 0
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64121 29196254 1 SN4O5H22C25 AB4C5D22E25 -26.51 6.66 -8.6 -1.48 0
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64122 29196257 1 SN3O4H25C26 AB3C4D25E26 -62.4 3.79 -8.34 -0.83 0
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64123 29196260 1 SN3O4H25C26 AB3C4D25E26 -67.37 7.17 -8.2 -0.34 0
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64124 29196269 1 SN3O4H25C26 AB3C4D25E26 -58.75 2.52 -8.33 -0.85 0
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64125 29196272 1 SN3O3C17H23 AB3C3D17E23 -90.15 6.82 -9.63 -1.27 0
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64126 29196275 1 SN3O3H23C25 AB3C3D23E25 -17.72 5.16 -8.63 -0.92 0
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64127 29196280 1 FON3C17H22 ABC3D17E22 -61.75 2.34 -9.32 -0.67 0
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64128 29196281 1 SO2N3H23C25 AB2C3D23E25 11.54 4.02 -8.72 -1.05 0
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64129 29196283 1 ON2C15H20 AB2C15D20 -25.43 6.1 -8.58 -0.17 0
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64130 29196284 1 SO2N3H23C25 AB2C3D23E25 11.43 3.98 -8.7 -1.04 0
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64131 29196285 1 SF2N4O4C23H26 AB2C4D4E23F26 -204.12 4.63 -8.92 -0.98 0
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64132 29196292 1 SN3O3H23C26 AB3C3D23E26 -23.78 5.91 -8.92 -1.22 0
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64133 29196297 1 SO2N3H25C26 AB2C3D25E26 6.06 3.99 -8.79 -1.02 0
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64134 29196304 1 SN4O5H22C25 AB4C5D22E25 -25.66 5.43 -8.52 -1.85 0
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64135 29196306 1 BrSO2N3H20C24 ABC2D3E20F24 20.8 5.32 -8.64 -0.85 0
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64136 29196309 1 BrSO2N3H20C24 ABC2D3E20F24 17.51 2.19 -8.72 -1.0 0
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64137 29196322 1 FSN3O5C22H22 ABC3D5E22F22 -163.44 4.11 -9.16 -1.11 0
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64138 29196324 1 SN3O4H25C26 AB3C4D25E26 -59.2 2.0 -8.29 -0.75 0
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64139 29196326 1 SCl2N2O3C17H18 AB2C2D3E17F18 -97.09 3.29 -9.53 -1.23 0
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64140 29196328 1 FSN3O5C21H24 ABC3D5E21F24 -201.66 2.69 -9.08 -0.92 0
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64141 29196527 1 ClN2O3C20H23 AB2C3D20E23 -103.68 1.95 -9.21 -0.51 0
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64142 29196558 1 SN4O4C26H34 AB4C4D26E34 -140.92 8.51 -8.37 -0.54 0
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64143 29196560 1 ClON2H17C18 ABC2D17E18 5.9 2.86 -8.48 -0.44 0
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64144 29196579 1 BrN4O4H11C16 AB4C4D11E16 70.91 3.74 -9.74 -1.69 0
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64145 29196639 1 N2O6C21H32 A2B6C21D32 -245.16 1.63 -8.49 -0.24 0
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64146 29196676 1 O2S2N3C16H19 A2B2C3D16E19 1.74 5.39 -8.54 -0.89 0
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64147 29196681 1 SO4N5C17H27 AB4C5D17E27 -74.87 6.84 -9.91 -1.78 0
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64148 29196706 1 SN5O5C19H27 AB5C5D19E27 -102.55 8.5 -9.29 -1.49 1
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64149 29196801 1 SO2N3C19H24 AB2C3D19E24 -1.03 5.4 0.0 0.0 1
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64150 29196843 1 SO2N3C20H26 AB2C3D20E26 -3.66 5.56 0.0 0.0 0