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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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217174 85087373 1 NO3C21H25 AB3C21D25 -92.02 3.88 -8.9 0.08 0
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217175 85087376 1 NOC23H33 ABC23D33 -38.69 4.15 -9.64 -0.76 0
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217176 85087377 1 NOSiC21H29 ABCD21E29 -28.66 0.93 -9.26 -0.09 0
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217177 85087378 1 ClON7C15H20 ABC7D15E20 39.16 10.3 -8.95 -0.29 0
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217178 85087379 1 ClON3H18C19 ABC3D18E19 39.84 5.27 -8.56 -0.96 0
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217179 85087380 1 ClNOSC18H26 ABCDE18F26 -49.88 2.74 -8.73 -0.34 0
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217180 85087384 1 N2O4C19H20 A2B4C19D20 -129.83 5.91 -9.07 -0.2 0
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217181 85087385 1 N2O4C19H20 A2B4C19D20 -82.84 4.24 -8.45 -0.84 0
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217182 85087387 1 O2F3C19H23 A2B3C19D23 -267.76 3.36 -9.06 -0.1 0
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217183 85087388 1 SO6C16H20 AB6C16D20 -231.98 4.0 -9.78 -0.53 0
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217184 85087389 1 SN2O3H16C18 AB2C3D16E18 -27.17 4.14 -9.07 -1.47 0
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217185 85087393 1 ClO6C16H17 AB6C16D17 -235.13 2.03 -8.99 -0.29 0
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217186 85087396 1 N3O4C18H19 A3B4C18D19 -41.12 3.15 -8.6 -0.47 0
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217187 85087397 1 FO2N3C19H20 AB2C3D19E20 -73.72 5.86 -9.32 -0.3 0
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217188 85087398 1 SN3O5C14H19 AB3C5D14E19 -136.49 6.83 -9.89 -0.71 0
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217189 85087399 1 NO6C17H27 AB6C17D27 -272.15 0.71 -10.34 -0.66 0
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217190 85087401 1 ON7C17H29 AB7C17D29 46.91 6.41 -8.66 0.49 0
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217191 85087402 1 FNO2C21H24 ABC2D21E24 -113.38 2.58 -9.16 -0.13 0
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217192 85087403 1 NO5C18H31 AB5C18D31 -158.0 2.06 -9.18 -0.31 0
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217193 85087404 1 NSO2C20H23 ABC2D20E23 -75.79 5.63 -9.33 -0.18 0
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217194 85087405 1 NSO2C20H23 ABC2D20E23 -27.23 3.12 -9.27 -0.49 0
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217195 85087406 1 NSiO4C17H31 ABC4D17E31 -234.31 2.78 -8.85 0.41 0
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217196 85087407 1 NSiO4C17H31 ABC4D17E31 -228.29 3.84 -9.44 0.72 0
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217197 85087408 1 ClFN5C17H21 ABC5D17E21 16.61 5.09 -9.14 -0.08 0
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217198 85087409 1 ClNO3H16C19 ABC3D16E19 -69.36 2.37 -9.13 -0.76 0
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217199 85087411 1 ClFNO2C18H25 ABCD2E18F25 -136.01 1.83 -9.01 -0.13 0
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217200 85087413 1 FO9C13H23 AB9C13D23 -452.97 1.81 -10.26 0.26 0
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217201 85087414 1 O6H18C19 A6B18C19 -201.02 4.74 -8.97 -0.86 0
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217202 85087415 1 N2O5C18H18 A2B5C18D18 -113.7 10.72 -8.64 -0.59 0
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217203 85087417 1 N4O4C17H20 A4B4C17D20 -108.8 3.9 -8.78 -0.92 0
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217204 85087418 1 FON2H15C22 ABC2D15E22 46.12 3.17 -8.61 -1.45 0
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217205 85087424 2 SN2O2C6H7 AB2C2D6E7 -103.46 4.24 -9.06 -1.97 0
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217206 85087425 1 SO2N4C17H18 AB2C4D17E18 25.41 9.29 -8.64 -1.11 0
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217207 85087426 1 SO2N4C17H26 AB2C4D17E26 -22.85 7.26 -8.45 -0.82 0
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217208 85087427 6 OC3H5 AB3C5 -232.9 2.65 -9.38 0.09 0
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217209 85087428 1 O4C21H26 A4B21C26 -173.86 3.79 -8.8 -0.48 0
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217210 85087429 1 N2O3C20H26 A2B3C20D26 -102.91 3.32 -9.58 -0.01 0
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217211 85087430 1 SO3C20H22 AB3C20D22 33.17 1.26 -9.1 -1.1 0
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217212 85087434 1 BrN2O3C14H19 AB2C3D14E19 -84.47 4.88 -9.44 -0.58 0
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217213 85087441 1 NO4C20H25 AB4C20D25 -143.99 2.59 -9.22 -0.35 0
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217214 85087445 1 NSiO5C16H29 ABC5D16E29 -293.28 1.57 -9.71 0.35 0
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217215 85087446 1 LiNSiO2C19H34 ABCD2E19F34 -91.56 13.06 -5.6 0.46 1
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217216 85087448 1 ClN5O6C11H11 AB5C6D11E11 -129.16 3.19 0.0 0.0 0
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217217 85087449 1 ClNO2C20H22 ABC2D20E22 -70.99 6.41 -9.4 -1.24 0
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217218 85087450 1 ClO2N5C15H26 AB2C5D15E26 -90.11 2.87 -9.5 -0.48 0
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217219 85087454 1 N4O4C17H20 A4B4C17D20 -98.71 2.9 -9.46 -0.47 0
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217220 85087455 1 OPH21C23 ABC21D23 25.41 4.9 -8.68 -0.2 0
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217221 85087459 1 O4C21H28 A4B21C28 -144.01 3.62 -9.33 0.35 0
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217222 85087460 1 O4C21H28 A4B21C28 -162.3 4.73 -8.93 -0.65 0
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217223 85087461 1 N2O5C17H32 A2B5C17D32 -290.81 1.79 -9.78 0.69 0