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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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144244 53336979 1 SO3N5C26H33 AB3C5D26E33 -54.62 4.86 -8.69 -0.29 0
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144245 53336980 1 SO3N5C22H31 AB3C5D22E31 -56.99 5.83 -8.72 -0.23 0
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144246 53337583 1 SO3N4H20C21 AB3C4D20E21 23.07 7.19 -8.38 -0.8 0
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144247 53337673 1 NSO4H9C10 ABC4D9E10 -109.66 4.7 -10.63 -1.4 0
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144248 53337738 1 BrClO2N4C19H22 ABC2D4E19F22 -46.97 8.5 -8.69 -0.95 -1
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144249 53337747 1 O2N3S3H10C13 A2B3C3D10E13 49.71 13.79 0.0 0.0 0
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144250 53338032 1 SF2N3O3C17H17 AB2C3D3E17F17 -135.25 7.17 -8.89 -1.31 0
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144251 53338297 1 ClSN3C19H20 ABC3D19E20 68.0 2.1 -7.72 -0.36 1
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144252 53338510 1 NOC23H30 ABC23D30 63.73 2.87 0.0 0.0 0
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144253 53338591 1 SN3O5C17H23 AB3C5D17E23 -174.48 4.21 -8.77 -1.53 0
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144254 53338734 1 NO2C6H13 AB2C6D13 -99.83 3.45 -9.22 1.86 0
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144255 53338910 1 ClON3H18C24 ABC3D18E24 85.83 3.82 -9.06 -1.46 0
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144256 53338911 1 N3O3F9H28C29 A3B3C9D28E29 -533.12 10.14 -9.73 -0.85 0
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144257 53338912 1 Cl2S2N4O4C21H24 A2B2C4D4E21F24 -121.06 7.16 -9.24 -1.82 0
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144258 53338913 1 NO4C16H23 AB4C16D23 -174.99 3.26 -9.41 0.16 0
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144259 53338961 2 NOC9H10 ABC9D10 -7.22 5.48 -9.56 -0.63 0
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144260 53339496 1 SN4O6C23H32 AB4C6D23E32 -223.68 5.09 -9.34 -0.92 0
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144261 53339816 2 SO2F3N7C18H23 AB2C3D7E18F23 -389.75 6.95 -9.08 -1.92 0
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144262 53339962 1 ClOF3N6C30H32 ABC3D6E30F32 -121.4 2.85 -8.13 -0.8 0
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144263 53339963 1 ClOF3N4H18C23 ABC3D4E18F23 -119.11 3.22 -8.22 -0.99 0
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144264 53340136 1 SO2N4C28H36 AB2C4D28E36 -45.45 1.47 -8.4 -0.6 0
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144265 53340168 1 SF3N3O8C33H36 AB3C3D8E33F36 -424.11 4.62 -9.39 -0.93 0
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144266 53340173 2 NO4C17H26 AB4C17D26 -206.59 6.13 -9.22 -0.78 0
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144267 53340195 1 O3N5C25H37 A3B5C25D37 -80.67 6.04 -8.89 -0.33 0
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144268 53340596 1 FON5C20H20 ABC5D20E20 -8.75 4.11 -9.09 -0.59 0
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144269 53340851 1 NO2C32H63 AB2C32D63 -174.35 1.34 -8.76 1.23 0
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144270 53340852 1 NO2C34H65 AB2C34D65 -161.35 2.11 -8.58 1.33 0
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144271 53340853 1 NO2C32H61 AB2C32D61 -169.0 1.33 -8.87 1.35 0
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144273 53340994 1 NF3O3H20C23 AB3C3D20E23 -252.21 3.75 -8.93 -0.65 0
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144274 53340995 1 NF3O3C20H20 AB3C3D20E20 -278.92 5.67 -9.52 -0.63 0
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144275 53340996 1 NCl2O3H17C18 AB2C3D17E18 -121.74 6.84 -9.77 -0.65 0
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144276 53341177 1 SF3N4O4H21C25 AB3C4D4E21F25 -189.72 6.54 -9.12 -1.07 0
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144277 53341178 1 SF4N6O6H28C29 AB4C6D6E28F29 -326.62 5.41 -8.37 -1.37 0
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144278 53341285 1 ClNF3O3H17C19 ABC3D3E17F19 -280.42 4.31 -9.58 -0.71 0
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144279 53341470 1 ClO2F3N3H21C22 AB2C3D3E21F22 -215.82 6.94 -9.26 -1.18 0
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144280 53342048 1 NO4H31C32 AB4C31D32 -63.82 2.86 -8.79 0.07 0
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144281 53342361 1 SeH20C27 AB20C27 101.2 0.52 -8.77 -0.55 0
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144282 53342547 1 NSiO3C18H37 ABC3D18E37 -176.23 2.36 -8.85 0.17 1
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144283 53344315 1 NC17H24 AB17C24 66.66 0.67 0.0 0.0 0
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144284 53344385 2 BN3O5C56H85 AB3C5D56E85 -266.09 5.06 -7.56 -0.61 0
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144285 53344723 1 O3N5C28H39 A3B5C28D39 -84.92 9.05 -8.31 -0.75 0
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144286 53344870 1 F2O4N6H32C33 A2B4C6D32E33 -154.74 8.2 -8.74 -1.57 0
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144287 53344871 1 F2O4N7C36H37 A2B4C7D36E37 -147.9 9.33 -8.65 -1.52 0
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144288 53344971 1 ClOF3N3H27C29 ABC3D3E27F29 -125.93 4.51 -8.78 -0.95 0
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144289 53345058 1 O2N4C21H26 A2B4C21D26 -60.84 7.04 -9.32 -0.47 0
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144290 53345159 1 N2O4F5H37C40 A2B4C5D37E40 -357.94 9.26 -8.94 -0.87 0
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144291 53345444 1 SN2O3H22C24 AB2C3D22E24 -41.72 7.09 -9.1 -0.7 0
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144292 53345945 8 OC3H4 AB3C4 -365.21 5.95 -10.56 -0.51 0
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144293 53346018 1 ON4C22H28 AB4C22D28 33.87 2.09 -8.94 0.16 0
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144294 53346069 1 SO2F3N7C29H30 AB2C3D7E29F30 -147.95 9.66 -8.43 -1.43 0
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144295 53346070 1 SF3O4N6H29C30 AB3C4D6E29F30 -240.8 2.49 -8.56 -1.23 0
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144296 53346071 1 SO2F3N5H20C28 AB2C3D5E20F28 -110.89 4.75 -8.58 -1.18 0
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144297 53346072 1 SO2F3N6H19C27 AB2C3D6E19F27 -100.87 3.45 -8.62 -1.57 0
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144298 53346599 1 ClN2O2C12H17 AB2C2D12E17 -80.37 1.54 -9.5 -0.19 0
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144299 53346600 2 NOC6H8 ABC6D8 -44.34 0.49 -9.41 -0.05 -1
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144300 53346789 1 ClON2C19H26 ABC2D19E26 -47.21 4.47 0.0 0.0 -1
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144301 53346790 1 BrSN4H12C14 ABC4D12E14 95.42 4.94 0.0 0.0 -1
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144302 53346971 1 NCl2O2C18H22 AB2C2D18E22 -28.71 2.62 0.0 0.0 -1
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144303 53347164 1 ClN2O2C25H26 AB2C2D25E26 40.65 1.53 0.0 0.0 -1
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144304 53347165 1 ClON2C14H18 ABC2D14E18 24.63 3.04 0.0 0.0 -1
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144305 53347166 1 ClNO4C23H35 ABC4D23E35 -164.54 4.65 0.0 0.0 -1
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144306 53347167 1 N2Cl3O3C21H26 A2B3C3D21E26 -55.53 5.15 0.0 0.0 -1
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144307 53347321 1 ISN2O3C23H28 ABC2D3E23F28 -88.08 4.03 0.0 0.0 -1
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144308 53347377 1 BrClNO3C17H26 ABCD3E17F26 -132.74 3.6 0.0 0.0 -1
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144309 53347493 1 ClO3N6C20H26 AB3C6D20E26 55.22 6.71 0.0 0.0 -1
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144310 53347494 1 ClS2N4O4C27H36 AB2C4D4E27F36 -113.66 4.11 0.0 0.0 0
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144311 53348535 3 OC7H14 AB7C14 -229.41 3.64 -9.8 1.65 0
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144312 53348587 1 SiO2C31H42 AB2C31D42 -108.25 3.76 -9.12 -0.02 0
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144313 53348784 1 N3H13C16 A3B13C16 126.26 5.2 -7.75 -1.14 0
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144314 53348785 1 O2N3H15C17 A2B3C15D17 55.38 3.64 -7.71 -1.02 0
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144315 53348873 1 NO7C21H29 AB7C21D29 -284.73 6.71 -8.6 -0.48 0
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144316 53349759 1 O7H18C19 A7B18C19 -223.43 4.45 -9.56 -1.27 0
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144317 53349760 1 SiO4C17H24 AB4C17D24 -190.96 6.18 -9.74 -0.11 0
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144318 53349981 2 BrSF2H4C9 ABC2D4E9 -86.07 3.32 -8.91 -1.45 0
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144319 53350131 1 NO4C25H27 AB4C25D27 -104.71 2.14 -8.65 -1.4 0
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144320 53350276 1 FeS2N4F6O6C16H32 AB2C4D6E6F16G32 -546.89 3.4 -8.42 -0.87 0
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144321 53350277 1 FeS2F6N6O6C23H30 AB2C6D6E6F23G30 -465.44 10.08 -8.84 -0.78 -1
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144322 53350405 1 ClNO2C17H25 ABC2D17E25 -66.56 2.34 0.0 0.0 -1
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144323 53350841 1 ClN2C17H18 AB2C17D18 53.9 3.91 0.0 0.0 -1
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144324 53350843 1 ClON2C16H16 ABC2D16E16 54.39 5.77 0.0 0.0 -1
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144325 53350888 1 ClNPO3C20H28 ABCD3E20F28 -180.89 2.76 0.0 0.0 -1
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144326 53350889 1 ClN4C24H26 AB4C24D26 145.21 2.7 0.0 0.0 -1
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144327 53350890 1 ClOSN2C10H18 ABCD2E10F18 -27.0 2.46 0.0 0.0 -1
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144328 53350895 1 BrOSN2H14C17 ABCD2E14F17 71.62 2.22 0.0 0.0 -1
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144329 53350896 1 NOSCl2H10C11 ABCD2E10F11 34.24 2.44 0.0 0.0 -1
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144330 53350897 1 ClN2O2C10H16 AB2C2D10E16 -24.57 4.01 0.0 0.0 -1
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144331 53351190 1 SCl3O3N4C18H20 AB3C3D4E18F20 -42.76 6.05 0.0 0.0 -1
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144332 53351381 1 ClON3C11H17 ABC3D11E17 0.13 2.74 0.0 0.0 -1
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144333 53351387 1 SCl3N3C15H15 AB3C3D15E15 72.85 2.42 0.0 0.0 -1
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144334 53351435 1 ClNSH11C13 ABCD11E13 70.12 1.79 0.0 0.0 -1
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144335 53351635 1 SCl2N3C14H16 AB2C3D14E16 82.14 5.04 0.0 0.0 -1
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144336 53351636 1 ClON3C15H23 ABC3D15E23 -4.85 3.33 0.0 0.0 -1
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144337 53351760 1 BrFO2N3H16C17 ABC2D3E16F17 -22.29 3.16 0.0 0.0 -1
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144338 53351762 1 ClN2C12H12 AB2C12D12 87.33 0.95 0.0 0.0 -1
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144339 53351825 1 Cl2N2C11H11 A2B2C11D11 32.93 3.08 0.0 0.0 -1
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144340 53351826 1 NOCl2H12C16 ABC2D12E16 47.72 4.93 0.0 0.0 -1
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144341 53351976 1 ClN3O3C27H35 AB3C3D27E35 -19.94 3.33 0.0 0.0 -1
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144342 53352556 1 ClN2O3C21H30 AB2C3D21E30 -47.34 2.18 0.0 0.0 -1
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144343 53352719 1 ClOSN3C24H25 ABCD3E24F25 63.03 3.93 0.0 0.0 -1
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144344 53352743 1 ClOSN3C24H25 ABCD3E24F25 32.77 4.05 0.0 0.0 -1