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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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167404 74820172 1 N2O7C37H42 A2B7C37D42 -196.66 3.84 -8.18 -1.01 0
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167405 74820173 1 N2O7C36H46 A2B7C36D46 -242.16 4.31 -7.95 -1.1 0
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167406 74820590 1 NOSH23C27 ABCD23E27 52.19 1.9 -8.34 -0.62 0
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167407 74820835 1 NSO5C32H47 ABC5D32E47 -241.33 5.87 -8.31 -0.07 0
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167408 74822079 1 ClFSO2N3H15C21 ABCD2E3F15G21 2.18 7.0 -9.77 -1.54 0
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167409 74823161 1 FN4O4H19C22 AB4C4D19E22 -107.45 3.92 -9.3 -1.38 0
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167410 74823662 1 NOSC23H23 ABCD23E23 4.98 2.32 -8.7 -0.7 -1
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167411 74823978 1 N2O5C17H21 A2B5C17D21 -177.65 4.44 0.0 0.0 -1
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167412 74823979 1 N2O4C19H25 A2B4C19D25 -140.66 5.38 0.0 0.0 0
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167413 74824579 1 SN3O4C20H25 AB3C4D20E25 -158.2 4.64 -8.88 -0.46 0
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167414 74825095 1 N2C3H4O4 A2B3C4D4 -86.84 4.05 -10.22 -0.75 0
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167415 74825096 1 O2S2N3C12H15 A2B2C3D12E15 25.28 35.64 -7.22 -2.18 0
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167416 74825473 1 FN2O3C20H21 AB2C3D20E21 -76.1 4.67 -9.3 -0.64 1
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167417 74825474 3 N2C7H9 A2B7C9 111.51 3.22 0.0 0.0 1
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167418 74825475 1 O2N3C20H28 A2B3C20D28 -13.38 4.22 0.0 0.0 1
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167419 74825716 1 N4O4C20H29 A4B4C20D29 -111.39 12.34 0.0 0.0 1
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167420 74825971 1 ON3C28H40 AB3C28D40 -0.65 5.69 0.0 0.0 0
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167421 74826475 1 SN8O14C31H52 AB8C14D31E52 -665.91 4.84 -8.85 -0.88 0
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167422 74826543 1 ClSO2N3C23H24 ABC2D3E23F24 -22.6 3.79 -9.17 -0.95 0
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167423 74827168 1 ClON3C17H20 ABC3D17E20 -12.07 5.07 -9.34 -0.96 0
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167424 74827398 1 ClO2F3N4H14C21 AB2C3D4E14F21 -115.24 4.3 -9.6 -1.76 0
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167425 74827399 1 N3O4C25H25 A3B4C25D25 -59.4 7.05 -8.57 -0.32 0
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167426 74827494 1 O2N5H15C17 A2B5C15D17 72.43 7.51 -9.39 -1.76 0
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167427 74827539 1 O2N5C19H19 A2B5C19D19 54.21 8.22 -9.2 -1.73 0
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167428 74827669 2 NOC16H16 ABC16D16 21.67 4.83 -8.2 -0.06 0
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167429 74827670 1 NOC24H29 ABC24D29 -14.77 4.06 -9.15 0.08 0
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167430 74827671 1 NOC25H31 ABC25D31 -15.54 3.73 -8.94 -0.16 0
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167431 74827672 1 ON2H26C27 AB2C26D27 51.49 5.02 -8.6 -0.16 0
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167432 74827673 1 N2O2C33H34 A2B2C33D34 15.23 4.56 -8.38 0.15 0
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167433 74827674 1 ClNOH22C24 ABCD22E24 30.06 4.01 -9.16 -0.54 0
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167434 74828412 1 Cl2O3N5C18H23 A2B3C5D18E23 -94.73 0.94 -8.98 -0.67 0
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167435 74828413 1 ClFSO3N5C25H29 ABCD3E5F25G29 -120.09 5.03 -8.89 -0.76 0
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167436 74828414 1 ClFSO3N5C27H31 ABCD3E5F27G31 -109.84 5.47 -8.84 -0.78 1
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167437 74828789 1 P3N7O17C21H25 A3B7C17D21E25 -772.33 4.11 0.0 0.0 0
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167438 74828790 1 N2I4O5H10C15 A2B4C5D10E15 -8.15 2.26 -9.24 -1.54 0
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167439 74828791 1 N2I4O5H12C15 A2B4C5D12E15 -85.49 4.57 -9.26 -1.59 0
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167440 74828931 1 SP3N7O17C27H40 AB3C7D17E27F40 -842.41 9.88 -9.38 -1.06 -1
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167441 74829065 1 NiFe4S5H9 AB4C5D9 -131.38 1.97 0.0 0.0 1
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167442 74829066 1 P3N5C10O13H15 A3B5C10D13E15 -628.56 2.01 0.0 0.0 0
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167443 74829193 1 ZnS2N4O4C34H34 AB2C4D4E34F34 170.97 12.21 -8.58 -2.43 1
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167444 74829194 1 FeS2N4O4H33C34 AB2C4D4E33F34 133.05 2.61 0.0 0.0 0
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167445 74829228 1 P2O17C36H68 A2B17C36D68 -1013.01 8.05 -10.6 0.22 0
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167446 74829234 1 SO5N10C38H50 AB5C10D38E50 -138.15 5.36 -8.44 -0.24 -2
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167447 74829358 1 MgN4O4C35H40 AB4C4D35E40 -121.44 6.89 -6.88 -1.54 0
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167448 74829359 1 N4O4C35H44 A4B4C35D44 -110.59 1.93 -7.49 -0.9 0
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167449 74830085 2 OSN3C25H28 ABC3D25E28 45.92 5.59 -8.39 -0.26 0
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167450 74830139 1 N4O6C25H28 A4B6C25D28 -141.82 5.03 -8.88 -1.36 0
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167451 74830232 2 N7O9C30H38 A7B9C30D38 -709.12 6.6 -8.8 -0.43 0
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167452 74830233 1 BrS2N7O9C58H74 AB2C7D9E58F74 -277.37 7.89 -6.95 -0.74 0
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167453 74830234 1 N9O11C63H73 A9B11C63D73 -358.03 9.55 -8.6 -0.66 0