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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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159393 57269800 1 ClSO4N8C19H25 ABC4D8E19F25 -65.22 3.97 -8.45 -0.61 0
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159394 57269801 2 NC11H24 AB11C24 -85.03 3.11 -8.72 3.05 0
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159395 57269808 1 N5C11H15 A5B11C15 103.7 1.59 -10.02 -2.36 0
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159396 57269811 1 SBr2C3H4 AB2C3D4 16.27 1.11 -9.32 -1.23 0
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159397 57269813 1 O3C37H58 A3B37C58 -182.67 2.39 -9.04 -0.69 0
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159398 57269815 1 OCl2H8C11 AB2C8D11 -27.76 4.56 -9.95 -1.45 0
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159399 57269816 1 N2C9H14 A2B9C14 49.65 3.43 -9.8 0.78 0
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159400 57269827 1 Cl2N3O8H15C19 A2B3C8D15E19 -194.4 2.23 -10.05 -1.21 0
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159401 57269833 2 FC3H3 AB3C3 -79.82 1.11 -9.65 0.67 2
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159402 57269840 2 NO5C23H33 AB5C23D33 -410.2 8.79 -6.16 -0.64 0
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159403 57280000 1 N3O3C22H23 A3B3C22D23 1.83 4.99 -8.81 -1.43 0
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159404 57280009 1 O5C24H40 A5B24C40 -272.12 2.98 -9.04 0.43 0
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159405 57280010 1 OSN2C6H14 ABC2D6E14 -54.67 4.27 -9.04 0.45 0
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159406 57280011 1 OPSC2H5 ABCD2E5 -39.12 3.36 -9.51 -0.24 0
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159407 57280017 1 BrNO2C21H24 ABC2D21E24 -48.0 3.95 -8.18 -0.44 0
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159408 57280019 1 O6C19H20 A6B19C20 -225.12 7.39 -9.03 -0.65 0
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159409 57280025 1 N2S2O3C25H38 A2B2C3D25E38 -22.02 4.02 -8.28 -0.9 0
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159410 57280026 1 PSiO2C15H19 ABC2D15E19 -213.66 5.18 -8.74 -0.34 0
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159411 57280027 1 NO5H17C19 AB5C17D19 -73.67 3.89 -9.19 -0.89 0
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159412 57280038 1 NO5C25H43 AB5C25D43 -273.6 4.67 -9.24 -0.92 0
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159413 57280040 2 NOC4H4 ABC4D4 -16.4 2.59 -9.38 -0.85 0
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159414 57280043 1 FN2O3C25H27 AB2C3D25E27 -111.76 2.84 -9.11 -0.64 0
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159415 57280060 1 N3O3C6H17 A3B3C6D17 -136.37 1.49 -9.88 1.29 0
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159416 57280107 1 BrNPS2O3C4H7 ABCD2E3F4G7 -194.81 6.35 -9.09 -1.75 0
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159417 57280116 1 ClNO2C26H36 ABC2D26E36 -83.97 4.64 -8.32 -0.24 0
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159418 57280118 1 C9H14 A9B14 48.14 1.53 -7.94 0.7 0
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159419 57280120 1 O7C18H32 A7B18C32 -361.96 3.3 -10.47 -0.09 0
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159420 57280122 2 H3O3C8 A3B3C8 -38.69 8.06 -10.22 -2.56 0
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159421 57280123 1 N3C10H11 A3B10C11 53.64 3.3 -8.43 -0.38 0
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159422 57280125 1 BrNH10C11 ABC10D11 34.08 1.88 -8.6 -0.15 0
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159423 57280126 1 N2O3C15H20 A2B3C15D20 -113.57 7.38 -8.7 -0.79 0
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159424 57280128 2 C2O2H3 A2B2C3 -167.1 3.84 -10.96 0.27 0
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159425 57280129 1 NO2C19H23 AB2C19D23 -34.53 2.89 -8.81 -0.46 0
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159426 57280138 1 NOC16H21 ABC16D21 -16.42 3.71 -8.84 0.44 0
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159427 57280139 1 FC26H39 AB26C39 -82.85 2.14 -9.32 0.06 0
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159428 57280140 1 O3N6C44H44 A3B6C44D44 181.11 7.34 -8.75 -0.72 0
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159429 57280141 2 NO2C11H20 AB2C11D20 -248.61 4.66 -9.6 0.2 0
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159430 57280143 1 NOC11H15 ABC11D15 -48.4 4.71 -9.37 0.1 0
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159431 57280146 1 N5O5C35H37 A5B5C35D37 -40.49 3.03 -9.27 -1.03 0
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159432 57280148 1 OC35H52 AB35C52 -72.04 3.37 -8.98 -0.68 0
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159433 57280156 1 N3H9C11 A3B9C11 93.85 1.29 -9.36 -0.75 0
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159434 57280159 1 SO3C19H32 AB3C19D32 -171.24 4.57 -8.68 0.38 0
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159435 57280162 1 ClNO3C11H12 ABC3D11E12 -117.83 4.01 -9.65 -0.91 0
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159436 57280163 1 N3O5C24H33 A3B5C24D33 -159.69 7.14 -8.66 -0.24 0
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159437 57280166 1 NSO2C4H7 ABC2D4E7 -60.35 3.57 -9.15 -0.72 0
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159438 57280170 1 O2C13H14 A2B13C14 -24.75 2.39 -9.81 -0.51 0
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159439 57280172 1 ON4H14C17 AB4C14D17 131.62 6.07 -8.92 -0.67 0
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159440 57280178 1 SN6O8C40H46 AB6C8D40E46 -196.37 6.14 -8.2 -0.82 0
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159441 57280180 1 NO3C19H27 AB3C19D27 -143.3 4.77 -9.24 0.18 0
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159442 57280189 1 NPC2O2H6 ABC2D2E6 -88.83 4.47 -10.13 0.47 0