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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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229220 87567211 1 ClFSO2N3C23H25 ABCD2E3F23G25 -62.9 5.18 -9.26 -0.62 0
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229221 87567213 1 FSO3N5C24H30 ABC3D5E24F30 -41.52 5.42 -8.99 -0.3 0
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229222 87567215 1 NSO5C9H19 ABC5D9E19 -219.98 14.29 -10.03 -0.41 0
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229223 87567216 1 ClNOC13H26 ABCD13E26 -84.85 12.04 -8.4 0.07 0
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229224 87567217 2 NO2C5H8 AB2C5D8 -151.37 1.24 -9.9 0.16 0
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229225 87567219 1 N3O3C26H41 A3B3C26D41 -158.16 7.52 -8.9 -0.13 0
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229226 87567220 1 N3O3C26H41 A3B3C26D41 -157.04 6.7 -8.86 -0.13 0
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229227 87567221 1 N3O3C26H41 A3B3C26D41 -158.07 4.82 -8.85 -0.24 0
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229228 87567222 1 ClSO2N4C24H27 ABC2D4E24F27 -48.88 3.15 -8.76 -0.73 0
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229229 87567223 1 FNPO3C12H15 ABCD3E12F15 -204.99 4.56 -10.12 -1.02 0
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229230 87567224 1 BrNOC13H26 ABCD13E26 -77.87 12.09 -7.9 -0.41 0
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229231 87567225 1 SN2O3C20H20 AB2C3D20E20 29.35 1.81 -9.25 -1.18 0
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229232 87567226 1 OCl2C3N4H12 AB2C3D4E12 -78.82 5.2 -9.53 0.5 0
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229233 87567227 1 OC3N4H10 AB3C4D10 -8.77 2.01 -8.84 0.88 0
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229234 87567230 1 SF4O4H10C15 AB4C4D10E15 -269.07 7.33 -10.11 -1.52 0
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229235 87567232 1 OS2N4C15H18 AB2C4D15E18 45.27 2.13 -8.63 -0.74 0
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229236 87567234 1 O5C9H20 A5B9C20 -253.35 5.34 -9.9 0.16 0
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229237 87567235 1 NSO6C20H25 ABC6D20E25 -247.75 3.3 -9.36 -0.7 0
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229238 87567238 1 NSiO3C16H31 ABC3D16E31 -219.11 4.56 -8.97 0.81 0
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229239 87567239 1 O2F6N6C23H26 A2B6C6D23E26 -304.36 4.08 -8.6 -1.06 0
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229240 87567240 1 NSiO3C16H31 ABC3D16E31 -220.19 4.01 -8.94 0.7 0
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229241 87567243 1 FSN2O2C20H21 ABC2D2E20F21 -7.12 4.56 -9.14 -0.65 0
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229242 87567244 1 ClFSO2N3C23H29 ABCD2E3F23G29 -60.58 2.08 -8.6 -0.22 0
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229243 87567248 1 O3N5F6H23C29 A3B5C6D23E29 -267.91 5.79 -9.23 -1.01 0
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229244 87567249 1 FSN4O4C20H23 ABC4D4E20F23 -111.46 3.49 -9.18 -0.29 0
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229245 87567253 1 ClFSN3O4C26H31 ABCD3E4F26G31 -168.17 8.62 -9.06 -0.47 0
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229246 87567258 1 ClFSN3O3C26H33 ABCD3E3F26G33 -117.95 5.54 -8.84 -0.18 0
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229247 87567259 1 FSN3O3C26H32 ABC3D3E26F32 -89.34 4.59 -8.86 -0.34 0
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229248 87567266 1 NO7C9H17 AB7C9D17 -345.25 4.94 -10.63 -0.21 0
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229249 87567267 1 NO4C8H15 AB4C8D15 -202.42 6.86 -10.4 0.08 -1
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229250 87567268 1 N11O16C66H118 A11B16C66D118 -851.3 2.02 0.0 0.0 0
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229251 87567270 1 N10O13C59H108 A10B13C59D108 -714.21 4.78 -9.28 0.2 0
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229252 87567272 1 FSO3N5C28H30 ABC3D5E28F30 -14.66 4.62 -9.09 -0.49 0
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229253 87567273 1 SN3O3C35H37 AB3C3D35E37 -13.34 1.77 -8.74 -0.48 0
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229254 87567274 1 ClFSN3O3C25H31 ABCD3E3F25G31 -122.71 1.78 -9.02 -0.09 0
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229255 87567275 1 FSN3O3C25H30 ABC3D3E25F30 -88.55 7.44 -8.68 -0.16 0
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229256 87567277 1 FOSN3C21H22 ABCD3E21F22 17.51 1.83 -9.04 -0.82 1
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229257 87567279 1 N2F5C8H10 A2B5C8D10 -193.86 16.0 0.0 0.0 0
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229258 87567280 1 ON5C10H15 AB5C10D15 31.98 1.56 -8.37 -0.37 0
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229259 87567281 1 O2N7F8H31C34 A2B7C8D31E34 -321.55 3.51 -8.96 -0.91 -2
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229260 87567283 1 SiZrCl2C28H36 ABC2D28E36 7.95 10.43 -6.87 -2.81 0
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229261 87567285 1 FOSN3C21H24 ABCD3E21F24 16.63 1.6 -8.57 -0.12 -4
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229262 87567287 1 SiZrCl2C28H38 ABC2D28E38 -9.83 1.2 -6.62 -1.45 0
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229263 87567288 1 BrNOC9H18 ABCD9E18 -88.54 6.89 -9.48 0.13 0
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229264 87567290 1 CMnH2S2O6 ABC2D2E6 -131.61 7.4 0.0 0.0 0
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229265 87567291 1 CFIH4 ABCD4 -56.93 0.43 -9.92 -0.83 -2
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229266 87567292 1 SiZrCl2C26H32 ABC2D26E32 -135.06 5.64 -7.03 -0.65 -4
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229267 87567293 1 SiZrCl2C26H34 ABC2D26E34 310.89 9.08 -5.65 -3.61 0
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229268 87567296 1 NC15Cl33 AB15C33 -48.13 1.06 -10.15 -2.21 0
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229269 87567298 1 N2O4H18C19 A2B4C18D19 -100.48 4.47 -8.88 -1.13 0
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229270 87567299 1 BrN2O3C17H23 AB2C3D17E23 -142.27 3.06 -9.36 -2.32 0
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229271 87567301 1 SO3N4C35H38 AB3C4D35E38 5.81 7.01 -8.91 -0.56 0
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229272 87567302 1 N2O3H18C20 A2B3C18D20 1.44 6.29 -8.5 -1.43 0
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229273 87567306 1 O3F6N6C22H22 A3B6C6D22E22 -309.28 4.75 -7.82 -1.29 0
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229274 87567307 2 OF3N3H10C11 AB3C3D10E11 -305.05 2.77 -8.9 -0.85 0
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229275 87567308 1 N2O2F7H21C25 A2B2C7D21E25 -388.0 3.35 -9.8 -1.05 0
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229276 87567309 1 N2O2F7H21C25 A2B2C7D21E25 -384.59 8.85 -9.72 -0.7 0
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229277 87567310 1 N9O12C52H95 A9B12C52D95 -613.11 7.13 -9.31 -0.1 0
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229278 87567311 4 ON3C16H20 AB3C16D20 48.91 7.45 -8.33 -0.63 0
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229279 87567312 1 ClN2O4C8H19 AB2C4D8E19 -168.96 3.25 -9.64 -0.83 0
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229280 87567317 1 NSO4C12H15 ABC4D12E15 -125.97 6.31 -9.86 -0.7 0
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229281 87567324 1 NC8Br19 AB8C19 77.12 0.9 -9.41 -2.9 1
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229282 87567326 1 NSO4C16H24 ABC4D16E24 -140.23 4.77 0.0 0.0 0
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229283 87567327 1 ON3F6C26H37 AB3C6D26E37 -377.92 6.99 -8.27 -1.14 0
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229284 87567328 1 ClFSN3O4C29H37 ABCD3E4F29G37 -171.87 2.64 -8.82 -0.24 0
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229285 87567330 1 ON3F6C26H37 AB3C6D26E37 -381.12 8.13 -8.7 -1.06 0
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229286 87567331 1 ON3F6C26H37 AB3C6D26E37 -383.38 7.63 -8.8 -1.08 0
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229287 87567332 1 SN3F6O6H21C29 AB3C6D6E21F29 -448.2 12.83 -9.84 -1.45 1
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229288 87567333 1 SN3F6O6H20C29 AB3C6D6E20F29 -273.33 5.78 0.0 0.0 0
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229289 87567334 2 NF2C4H6 AB2C4D6 -183.94 3.71 -8.72 0.27 0
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229290 87567335 1 ClFSO3N4C22H26 ABCD3E4F22G26 -89.39 5.61 -9.04 -0.56 0
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229291 87567338 1 ClNO4C6H12 ABC4D6E12 -223.99 4.4 -9.22 0.58 0
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229292 87567341 1 SO5C7H10 AB5C7D10 -181.52 3.48 -10.79 -0.64 0
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229293 87567345 1 ClFSO3N4C22H26 ABCD3E4F22G26 -100.15 6.66 -8.92 -0.47 0
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229294 87567348 1 SCl2O2C6H8 AB2C2D6E8 -52.39 4.51 -10.41 -0.44 0