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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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36250 7982473 1 ClFSO2N4H14C17 ABCD2E4F14G17 -37.51 6.89 -8.76 -1.18 0
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36251 7982476 1 ClSO2N4C20H21 ABC2D4E20F21 1.08 9.32 -8.69 -1.07 0
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36252 7982488 1 ClSO2N4C19H19 ABC2D4E19F19 -1.46 9.74 -8.74 -1.2 0
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36253 7982489 1 SCl2O2N4H14C17 AB2C2D4E14F17 -1.83 9.76 -8.77 -1.24 0
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36254 7982490 1 ClSO3N4H17C19 ABC3D4E17F19 -33.56 7.77 -8.98 -1.18 0
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36255 7982531 1 N2O4H24C25 A2B4C24D25 -112.06 6.27 -8.88 -0.67 0
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36256 7982532 3 NO2C7H7 AB2C7D7 -176.98 4.81 -8.87 -0.82 0
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36257 7982574 1 N3O4H19C24 A3B4C19D24 -71.11 2.15 -9.28 -1.03 0
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36258 7982719 1 SN2O4C22H34 AB2C4D22E34 -196.04 5.12 -8.48 -0.33 0
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36259 7982802 1 ClSN3O6C15H18 ABC3D6E15F18 -165.76 4.0 -8.74 -2.08 0
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36260 7982848 1 SN2O4C19H28 AB2C4D19E28 -175.54 6.21 -8.49 -0.32 0
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36261 7982850 1 SN2O4C18H26 AB2C4D18E26 -169.99 7.9 -8.42 -0.12 0
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36262 7982851 1 SN2O4C22H32 AB2C4D22E32 -190.61 3.1 -8.8 -0.48 0
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36263 7983099 1 NO6C20H23 AB6C20D23 -228.61 9.02 -9.24 -1.05 0
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36264 7983219 1 O7H20C23 A7B20C23 -228.82 4.44 -9.1 -0.95 0
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36265 7983622 2 NO2C8H10 AB2C8D10 -123.7 7.92 -9.13 -0.24 0
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36266 7983731 1 ClN2O5H19C20 AB2C5D19E20 -141.66 7.08 -8.79 -0.79 0
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36267 7983970 1 ClSN2O3H15C20 ABC2D3E15F20 -18.8 5.13 -9.43 -1.33 0
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36268 7983971 1 ClSN2O3H15C20 ABC2D3E15F20 -17.25 6.32 -9.43 -1.32 0
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36269 7983973 1 SN3O4H17C20 AB3C4D17E20 -51.63 3.25 -9.53 -1.05 0
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36270 7985314 1 F2N2O4H12C17 A2B2C4D12E17 -186.95 2.41 -9.46 -1.09 0
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36271 7985315 1 NF2O5H17C22 AB2C5D17E22 -229.39 5.6 -8.97 -1.1 0
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36272 7985318 1 NF2O4H17C19 AB2C4D17E19 -220.34 5.82 -8.84 -1.0 0
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36273 7985319 1 F2N2O5C20H20 A2B2C5D20E20 -279.58 3.63 -8.97 -1.06 0
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36274 7985321 1 NF2O6H17C19 AB2C6D17E19 -306.86 3.82 -10.05 -1.39 0
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36275 7985348 1 NSCl2O3C13H15 ABC2D3E13F15 -136.11 1.98 -9.41 -1.11 0
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36276 8000187 1 FSN2O2H17C19 ABC2D2E17F19 -67.54 2.25 -9.13 -1.18 1
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36277 8000193 1 NC18H30 AB18C30 6.77 4.29 0.0 0.0 0
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36278 8000461 1 ClNO2F3H11C15 ABC2D3E11F15 -208.91 6.88 -9.27 -0.94 0
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36279 8000479 1 SN3O4H19C20 AB3C4D19E20 -27.67 8.79 -8.8 -1.48 0
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36280 8000490 1 NOC17H25 ABC17D25 -64.12 4.27 -9.44 -0.02 0
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36281 8000492 1 SN2O3C21H22 AB2C3D21E22 -72.74 4.36 -8.94 -0.86 1
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36282 8000509 1 ClON2C15H18 ABC2D15E18 -21.29 2.7 0.0 0.0 0
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36283 8000705 1 NC20H23 AB20C23 30.92 1.15 -8.77 -0.34 -1
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36284 8000711 1 F3N7H13C17 A3B7C13D17 52.45 3.8 0.0 0.0 0
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36285 8001014 1 ClSO2N3C17H18 ABC2D3E17F18 -24.34 8.08 -8.7 -0.57 0
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36286 8001020 1 FSO2N3C18H20 ABC2D3E18F20 -69.14 6.97 -8.75 -0.68 0
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36287 8001025 1 OS2N3C19H23 AB2C3D19E23 6.78 10.46 -8.61 -0.77 0
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36288 8001081 1 OSN4C20H20 ABC4D20E20 58.56 2.41 -8.78 -0.86 0
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36289 8001085 1 ClS2N4C16H17 AB2C4D16E17 70.4 2.61 -8.91 -0.89 0
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36290 8001102 2 SN2C6H8 AB2C6D8 70.63 2.53 -8.84 -0.45 0
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36291 8001113 1 ClS2N4C16H17 AB2C4D16E17 69.35 3.2 -8.95 -0.89 0
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36292 8001120 2 SN2C8H9 AB2C8D9 78.23 7.99 -8.48 -0.76 0
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36293 8001221 1 N4O4C21H26 A4B4C21D26 -148.74 5.46 -9.09 -0.49 1
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36294 8001223 1 F3N3O3C21H23 A3B3C3D21E23 -226.53 6.31 0.0 0.0 0
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36295 8001230 1 NSO5H19C21 ABC5D19E21 -129.37 3.32 -8.75 -0.97 0
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36296 8001239 1 SO2N4H20C21 AB2C4D20E21 -10.18 7.42 -9.02 -0.93 0
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36297 8001244 1 ClN2O3H19C22 AB2C3D19E22 -69.44 2.97 -8.64 -0.65 0
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36298 8001254 1 SN2O5C21H24 AB2C5D21E24 -158.34 1.99 -8.53 -1.23 0
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36299 8001261 1 SN3O5C17H17 AB3C5D17E17 -48.37 1.74 -8.37 -1.01 0