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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
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167454 74830235 1 N2F3O3H19C20 A2B3C3D19E20 -233.19 4.05 -8.74 -1.44 0
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167455 74830236 2 SO5N7C25H35 AB5C7D25E35 -383.61 17.63 -9.01 -0.52 0
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167456 74830325 1 PN6O14C36H51 AB6C14D36E51 -615.91 2.08 -9.1 -0.9 0
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167457 74830326 3 NO6C35H43 AB6C35D43 -631.36 6.18 -8.1 -0.24 0
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167458 74830327 1 O3N4C33H38 A3B4C33D38 -48.3 3.99 -8.57 -0.49 0
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167459 74830467 1 FOSN2H19C21 ABCD2E19F21 -21.04 2.0 -9.02 -1.53 0
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167460 74830468 1 PN6O12C38H55 AB6C12D38E55 -564.68 6.98 -9.1 -0.93 0
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167461 74831463 1 Cl2O3N6H30C31 A2B3C6D30E31 -17.95 7.05 -9.39 -1.07 0
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167462 74831877 1 O8C31H48 A8B31C48 -353.38 2.42 -8.82 -0.24 0
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167463 74831878 1 N3O3C14H27 A3B3C14D27 -149.38 1.91 -8.32 0.63 0
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167464 74831920 1 ON7C24H35 AB7C24D35 58.07 6.45 -8.79 -0.57 0
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167465 74832331 1 ClN3O3C17H24 AB3C3D17E24 -123.86 9.52 -8.7 -0.21 0
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167466 74832332 1 N3O4H9C11 A3B4C9D11 -97.97 4.36 -9.77 -1.27 0
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167467 74832372 1 FN3O5C16H18 AB3C5D16E18 -189.53 4.06 -9.58 -0.56 0
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167468 74832373 1 ClN4O7C17H19 AB4C7D17E19 -220.07 5.92 -9.79 -0.97 0
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167469 74832374 1 ClN3O5H16C17 AB3C5D16E17 -92.34 3.4 -9.45 -0.56 1
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167470 74832488 1 PN4F12H52C62 AB4C12D52E62 -479.32 21.27 0.0 0.0 0
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167471 74832597 1 N3O3C19H19 A3B3C19D19 -54.69 6.45 -9.04 -0.91 -1
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167473 74832945 1 SiO4C15H30 AB4C15D30 -250.87 2.73 -8.82 0.49 0
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167474 74833593 1 SN6O8C38H40 AB6C8D38E40 -116.38 6.9 -9.15 -1.12 0
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167475 74833594 1 SN6O8C39H42 AB6C8D39E42 -125.28 6.51 -9.0 -1.02 0
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167477 74833918 1 SN6O8C43H52 AB6C8D43E52 -111.83 7.63 -9.14 -1.35 0
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167478 74834083 1 SCl2N3O5C30H39 AB2C3D5E30F39 -256.17 11.82 -8.58 -0.98 0
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167479 74834084 1 SCl2N4O5C29H38 AB2C4D5E29F38 -240.77 11.08 -8.92 -0.9 0
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167480 74834195 1 SN4O6C28H34 AB4C6D28E34 -119.35 6.34 -9.22 -0.53 0
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167481 74834196 1 SN4O6C33H42 AB4C6D33E42 -137.95 7.02 -9.23 -0.15 0
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167482 74834832 1 N11O14C44H75 A11B14C44D75 -722.97 3.37 -9.82 -0.11 0
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167483 74834833 2 N5O7C22H35 A5B7C22D35 -664.2 7.64 -8.88 -0.21 0
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167484 74834834 1 O2N4C21H26 A2B4C21D26 -34.85 2.97 -8.97 -0.79 0
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167485 74834835 1 ON4C18H20 AB4C18D20 33.81 4.2 -9.06 -0.56 0
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167486 74834836 1 N4C23H24 A4B23C24 105.41 3.22 -8.67 -0.64 0
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167487 74835035 1 SO4N6C31H38 AB4C6D31E38 -114.66 3.63 -8.1 -0.52 0
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167488 74835371 1 SiO2C14H28 AB2C14D28 -146.9 1.86 -8.92 1.14 0
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167489 74835640 1 N2O2C21H34 A2B2C21D34 -109.48 8.91 -8.59 -0.47 0
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167490 74835922 1 N2O9C39H46 A2B9C39D46 -354.16 5.64 -8.89 -0.44 0
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167491 74835923 1 N2O9C37H42 A2B9C37D42 -341.5 4.59 -8.85 -0.4 0
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167492 74835924 1 SN2O9C39H46 AB2C9D39E46 -341.13 6.48 -8.66 -0.49 0
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167493 74835958 1 SO3N5C30H37 AB3C5D30E37 -51.21 4.54 -8.7 -0.37 0
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167494 74836211 1 O2N3C21H27 A2B3C21D27 -32.7 6.08 -8.68 -0.33 0
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167495 74836212 1 ON4C31H36 AB4C31D36 45.73 1.88 -8.72 0.06 0
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167496 74836213 1 ON4C32H34 AB4C32D34 64.94 3.7 -9.02 0.23 0
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167497 74836364 1 Cl2O2N6C31H42 A2B2C6D31E42 -77.79 5.92 -8.32 -0.24 0
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167498 74836691 1 SN2O5C36H38 AB2C5D36E38 -156.21 5.53 -8.79 -1.06 0
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167499 74836841 1 O3N4C22H28 A3B4C22D28 -76.33 9.58 -9.24 -0.33 0
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167500 74836872 1 FO3N4C27H29 AB3C4D27E29 -93.01 1.55 -9.0 -0.2 0
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167501 74837046 1 N4O5C24H36 A4B5C24D36 -208.66 4.48 -8.83 0.18 0
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167502 74837053 1 O3N4C19H24 A3B4C19D24 -35.79 4.13 -9.16 -1.49 0
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167503 74837148 1 O3N5C26H35 A3B5C26D35 -71.35 6.8 -8.66 -0.33 0
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167504 74837632 1 FN4O5C29H33 AB4C5D29E33 -162.73 4.13 -8.48 -0.05 0
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167505 74837721 1 N5O6C29H41 A5B6C29D41 -179.44 5.9 -8.53 -0.3 0