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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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217351 85087670 1 NO4C21H25 AB4C21D25 -109.43 7.5 -8.56 -0.51 0
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217352 85087671 1 N3O3C20H23 A3B3C20D23 -87.04 4.92 -9.69 -1.26 0
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217353 85087673 1 NO3C22H29 AB3C22D29 -116.81 4.12 -9.61 -0.22 0
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217354 85087674 1 NO3C22H29 AB3C22D29 -115.91 7.17 -9.46 -0.69 0
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217355 85087675 1 NO3C22H29 AB3C22D29 -6.36 6.98 -5.62 -2.11 0
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217356 85087677 1 NO4C20H37 AB4C20D37 -257.68 2.86 -9.65 0.69 0
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217357 85087678 1 NO2C23H33 AB2C23D33 -97.3 5.65 -8.46 -0.24 0
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217358 85087681 1 O3F5C16H17 A3B5C16D17 -343.82 4.43 -10.17 -1.36 0
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217359 85087690 1 SO2N4C18H28 AB2C4D18E28 -32.59 6.63 -8.4 -0.23 0
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217360 85087692 1 N2O3C21H28 A2B3C21D28 -62.11 1.61 -9.63 -0.37 0
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217361 85087693 1 OS2N4C16H28 AB2C4D16E28 -31.72 7.08 -8.09 0.32 0
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217362 85087694 1 SSiO2C19H36 ABC2D19E36 -147.99 1.62 -8.74 0.13 0
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217363 85087696 1 ClN2O4C17H25 AB2C4D17E25 -183.43 3.32 -9.0 -0.84 0
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217364 85087697 1 NOF6H9C17 ABC6D9E17 -274.92 4.2 -9.4 -1.47 0
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217365 85087698 1 BrN2C19H21 AB2C19D21 39.66 1.16 -8.43 -0.12 0
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217366 85087703 1 N3O6C16H27 A3B6C16D27 -265.01 4.46 -8.81 -0.08 0
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217367 85087704 1 NO3H19C23 AB3C19D23 -23.0 3.69 -9.04 -1.09 0
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217368 85087705 1 N3O4C19H33 A3B4C19D33 -207.74 6.59 -9.25 0.12 0
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217369 85087708 1 NO4C21H27 AB4C21D27 -179.24 4.41 -9.15 0.16 0
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217370 85087709 1 ON7C18H31 AB7C18D31 34.08 4.16 -8.66 0.2 0
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217371 85087710 1 NSO3C20H23 ABC3D20E23 -63.76 4.16 -8.81 0.08 0
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217372 85087711 1 OSN5C18H23 ABC5D18E23 16.02 3.39 -8.89 -0.78 0
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217373 85087714 1 NSiO4C18H35 ABC4D18E35 -254.92 2.51 -8.96 0.51 0
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217374 85087715 1 NSiO4C18H35 ABC4D18E35 -217.83 5.39 -8.82 0.35 0
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217375 85087719 2 O3C10H11 A3B10C11 -208.32 2.73 -8.45 -0.1 0