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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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233438 90944478 2 NH10C11 AB10C11 59.81 2.53 -7.92 -0.21 0
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233439 90944485 1 SN3O4C12H15 AB3C4D12E15 -111.1 8.72 -9.98 -0.8 1
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233440 90944492 1 O4N5H24C26 A4B5C24D26 78.41 5.78 0.0 0.0 0
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233441 90944495 2 NOC9H11 ABC9D11 -47.49 6.13 -9.71 -0.5 0
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233442 90944503 1 NS2O6H17C18 AB2C6D17E18 -64.53 4.88 -8.35 -1.78 0
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233443 90944504 2 F3O3N4C20H24 A3B3C4D20E24 -543.85 6.27 -8.75 -0.38 0
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233444 90944509 1 NC8H11 AB8C11 26.44 1.81 -8.08 0.43 0
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233445 90944510 1 N3O4C21H31 A3B4C21D31 -150.34 4.29 -7.98 -0.27 0
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233446 90944511 1 O2N4C31H34 A2B4C31D34 22.44 7.44 -7.93 -0.46 0
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233447 90944514 1 SCl2O2N5H25C27 AB2C2D5E25F27 81.53 5.91 -8.39 -1.28 0
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233448 90944515 1 FON2C29H33 ABC2D29E33 -43.56 4.65 -8.75 -0.24 0
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233449 90944518 1 BrON6C8H9 ABC6D8E9 86.62 3.69 -10.22 -1.69 0
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233450 90944523 1 NSO3C4H11 ABC3D4E11 -146.94 1.81 -9.49 0.07 0
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233451 90944524 1 SN2O3C10H10 AB2C3D10E10 -83.65 2.43 -9.14 -0.59 0
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233452 90944527 1 NO2S2H4F5C10 AB2C2D4E5F10 -233.46 5.1 -9.71 -2.37 0
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233453 90944529 1 O21C59H72 A21B59C72 -799.51 8.61 -9.47 -0.13 0
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233454 90944532 1 N2P2S4O8C39H42 A2B2C4D8E39F42 -316.41 8.86 -8.78 -0.66 0
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233455 90944538 1 C17H30 A17B30 -29.04 1.2 -9.11 1.6 0
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233456 90944544 1 SO3N5C27H27 AB3C5D27E27 -10.21 9.16 -8.81 -1.1 0
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233457 90944555 1 ClO2N5C19H24 AB2C5D19E24 -64.08 4.97 -8.41 -0.57 0
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233458 90944556 1 SN2C10H12 AB2C10D12 45.73 2.05 -8.15 0.0 0
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233459 90944581 1 F3H9C13 A3B9C13 -102.32 2.64 -9.8 -0.37 0
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233460 90944590 1 ClN3O3H26C28 AB3C3D26E28 -27.07 4.63 -8.91 -0.89 0
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233461 90944706 1 O2N9H37C38 A2B9C37D38 113.37 7.31 -8.96 -1.2 0
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233462 90944707 1 BrN4H11C13 AB4C11D13 102.37 3.06 -8.41 -1.04 0
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233463 90944708 1 O3N5H19C21 A3B5C19D21 -16.47 5.06 -7.8 -1.76 0
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233464 90944711 1 O4N5C23H31 A4B5C23D31 -113.3 7.75 -8.83 -0.92 0
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233465 90944715 1 OF4N5C26H27 AB4C5D26E27 -173.41 8.87 -9.36 -0.83 0
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233466 90944720 1 SiO5C25H36 AB5C25D36 -280.09 7.41 -8.87 -0.3 0
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233467 90944721 1 NSO8C22H35 ABC8D22E35 -330.29 2.33 -9.78 -0.49 0
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233468 90944726 1 N3O6H25C33 A3B6C25D33 -60.13 3.43 -9.11 -1.42 0
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233469 90944741 1 NO3C18H27 AB3C18D27 -139.0 4.2 -10.06 -1.47 0
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233470 90944765 30 CH AB 43.19 0.31 -8.05 -0.75 0
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233471 90944766 1 ClN2O4C18H25 AB2C4D18E25 -177.2 4.41 -8.38 -0.01 0
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233472 90944776 1 Cl7C10H11 A7B10C11 -65.91 3.55 -9.98 -0.49 0
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233473 90944780 1 OC18H28 AB18C28 -72.56 2.2 -8.89 1.44 0
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233475 90944786 1 ClNF3O4C18H19 ABC3D4E18F19 -327.15 4.5 -9.5 -1.55 0
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233476 90944788 1 O4C25H44 A4B25C44 -219.69 3.69 -9.27 0.07 0
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233477 90944789 2 OC16H32 AB16C32 -226.2 1.66 -9.18 1.42 0
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233478 90944793 1 FS3N7O17C72H72 AB3C7D17E72F72 -605.81 17.29 -8.27 -1.07 0
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233479 90944797 1 IO3Cl5N7C52H53 AB3C5D7E52F53 25.35 5.98 -8.73 -1.03 0
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233481 90944813 1 F3N3O4H20C24 A3B3C4D20E24 -204.73 1.58 -9.25 -1.14 0
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233482 90944818 2 H6F15C22 A6B15C22 -1191.36 3.45 -9.76 -2.05 0
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233483 90944820 4 C4H5 A4B5 14.16 1.04 -7.51 0.24 0
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233484 90944841 1 ClON3C13H14 ABC3D13E14 -14.0 5.02 -9.02 -0.81 0
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233485 90944843 1 OS2C7H12 AB2C7D12 -46.03 2.79 -8.94 -0.05 0
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233486 90944846 1 NO2S2H7C9 AB2C2D7E9 -5.22 5.69 -9.31 -0.82 0
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233487 90944848 1 FN9C27H34 AB9C27D34 65.88 2.2 -8.17 -0.51 0
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233488 90944852 1 ClC13H21 AB13C21 -48.33 2.92 -10.21 1.11 0
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233489 90944855 2 SCl2F3N3O4C20H20 AB2C3D3E4F20G20 -563.98 7.62 -8.79 -1.97 0