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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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54230 16955352 1 SN4O5C19H24 AB4C5D19E24 -141.19 4.33 -8.36 -0.81 0
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54231 16955353 1 ClSO3N4C22H23 ABC3D4E22F23 -24.29 5.96 -8.36 -0.74 0
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54232 16955354 1 FSO3N4C22H23 ABC3D4E22F23 -64.76 6.23 -8.33 -0.8 0
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54233 16955356 1 SN4O5C21H22 AB4C5D21E22 -88.4 4.15 -8.2 -0.83 0
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54234 16955361 1 SN3O3C16H21 AB3C3D16E21 -68.5 4.55 -8.25 -0.74 0
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54235 16955363 1 SN3O3C16H21 AB3C3D16E21 -71.37 6.98 -8.32 -0.75 0
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54236 16955366 1 SN3O3C15H17 AB3C3D15E17 -36.25 6.44 -8.36 -0.8 0
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54237 16955371 1 SN3O4C17H23 AB3C4D17E23 -107.02 3.39 -8.19 -0.83 0
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54238 16955372 1 SN3O5C16H21 AB3C5D16E21 -144.81 2.63 -8.19 -0.86 0
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54239 16955394 1 SN3O4C17H17 AB3C4D17E17 -59.43 6.98 -8.24 -0.86 0
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54240 16955396 1 SN3O3C20H21 AB3C3D20E21 -33.74 4.28 -8.17 -0.78 0
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54241 16956259 1 ClSO2N5H22C25 ABC2D5E22F25 43.01 12.09 -8.91 -1.75 0
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54242 16956266 1 ClSO2N6C29H29 ABC2D6E29F29 51.95 5.65 -8.8 -1.67 0
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54243 16956379 1 ClOF3N6H22C27 ABC3D6E22F27 -41.92 7.74 -8.29 -1.8 0
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54244 16956663 1 ClON4H19C21 ABC4D19E21 43.77 0.99 -8.3 -0.42 0
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54245 16956708 1 ClSN3O3H18C20 ABC3D3E18F20 -50.6 9.64 -8.59 -1.2 0
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54246 16956765 1 FNS3O4H12C15 ABC3D4E12F15 -127.27 5.29 -9.25 -1.65 0
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54247 16956767 1 NS2O4H17C19 AB2C4D17E19 -96.1 6.21 -8.51 -1.47 0
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54248 16956804 1 O2F3N3H18C21 A2B3C3D18E21 -144.65 3.85 -8.64 -1.45 0
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54249 16956949 1 ClO3N4H21C23 AB3C4D21E23 -36.87 5.58 -8.59 -1.0 0
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54250 16957123 1 Cl2O2N3H11C23 A2B2C3D11E23 56.43 5.32 -9.2 -1.77 0
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54251 16957193 1 Cl2O2N3C28H29 A2B2C3D28E29 -56.45 4.35 -9.29 -0.55 0
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54252 16957202 1 ClO2N3C29H32 AB2C3D29E32 -41.62 2.92 -8.87 -0.34 0
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54253 16957204 1 ClN3O3C30H34 AB3C3D30E34 -80.44 2.42 -8.58 -0.29 0
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54254 16957213 1 ClON2C15H23 ABC2D15E23 -44.99 4.17 -8.84 -0.08 0
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54255 16957223 1 FOSCl2N2H17C21 ABCD2E2F17G21 1.99 3.16 -8.7 -1.38 0
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54256 16957235 1 ClOSN3C19H20 ABCD3E19F20 40.54 4.15 -8.65 -1.13 0
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54257 16957236 1 ClSN2O2C18H19 ABC2D2E18F19 -35.21 2.13 -8.63 -1.15 0
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54258 16957239 1 ClSN3O3H20C22 ABC3D3E20F22 41.21 4.72 -8.59 -1.18 0
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54259 16957241 1 ClSN3O3H20C22 ABC3D3E20F22 37.78 5.0 -8.57 -1.82 0
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54260 16957243 1 SN3O3H21C22 AB3C3D21E22 59.23 6.79 -8.45 -1.62 0
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54261 16957244 1 ClSN3O3H20C22 ABC3D3E20F22 43.65 4.47 -8.45 -1.76 0
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54262 16957245 1 SN2O3C17H18 AB2C3D17E18 12.8 4.96 -8.35 -1.58 0
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54263 16957246 1 BrOSN2H21C22 ABCD2E21F22 61.79 4.77 -8.51 -1.08 0
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54264 16957247 1 BrFOSN2H18C21 ABCDE2F18G21 19.55 3.15 -8.64 -1.28 0
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54265 16957260 1 ClOSN2H21C22 ABCD2E21F22 44.53 5.13 -8.56 -1.13 0
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54266 16957267 1 BrSO2N3C15H16 ABC2D3E15F16 -14.31 5.8 -9.16 -1.11 0
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54267 16957269 1 SN3O4H21C22 AB3C4D21E22 -63.85 3.88 -8.09 -1.39 0
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54268 16957276 1 SO3N5C23H25 AB3C5D23E25 -24.64 5.68 -8.16 -1.25 0
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54269 16957281 1 SO3N4C24H26 AB3C4D24E26 -47.39 7.39 -8.87 -1.13 0
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54270 16957283 1 FSO3N4H21C22 ABC3D4E21F22 -81.27 9.14 -8.87 -1.33 0
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54271 16957304 1 OSF3N4C19H19 ABC3D4E19F19 -111.21 3.43 -9.05 -1.47 0
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54272 16957308 1 FOSN5C14H14 ABCD5E14F14 16.26 5.61 -9.04 -1.18 0
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54273 16957309 1 SO2N5C15H17 AB2C5D15E17 22.82 7.11 -8.81 -1.12 0
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54274 16957311 1 ClSO2N4C16H17 ABC2D4E16F17 6.49 5.2 -9.0 -1.25 0
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54275 16957321 1 SO3N4C17H20 AB3C4D17E20 -23.74 4.8 -8.85 -1.23 0
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54276 16957323 1 FOSN5H18C20 ABCD5E18F20 42.46 5.35 -8.78 -1.28 0
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54277 16957339 1 ON5H17C19 AB5C17D19 89.29 5.92 -8.97 -1.25 0
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54278 16957340 1 O3N4H18C20 A3B4C18D20 15.97 4.86 -9.05 -1.41 0
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54279 16957344 1 Cl2O2N5H13C14 A2B2C5D13E14 9.41 7.61 -8.97 -1.07 -1