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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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410605 135083405 1 N3O4H13C14 A3B4C13D14 34.38 5.35 -9.66 -1.59 0
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410606 135083406 1 N3O4C15H15 A3B4C15D15 29.86 5.49 -9.74 -1.58 0
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410607 135083407 1 N3O4C15H15 A3B4C15D15 27.15 5.42 -9.91 -1.58 0
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410608 135083408 2 N3O4C8H8 A3B4C8D8 33.4 8.35 -10.35 -1.65 0
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410609 135083409 2 ClH4N4O6C7 AB4C4D6E7 45.35 5.18 -11.07 -2.87 0
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410610 135083410 1 N3O4C16H17 A3B4C16D17 23.63 5.46 -9.71 -1.59 0
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410611 135083411 1 N3O4H13C15 A3B4C13D15 58.7 5.13 -9.77 -1.57 0
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410612 135083412 1 ON2C7H12 AB2C7D12 20.14 5.3 -9.25 -0.22 0
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410613 135083413 2 ClN4O4H6C8 AB4C4D6E8 89.52 3.07 -10.59 -2.17 0
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410614 135083414 2 Cl2N3H4O4C7 A2B3C4D4E7 27.93 7.38 -10.4 -2.14 0
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410615 135083415 2 ClN3O4H7C8 AB3C4D7E8 18.87 2.48 -10.24 -1.97 0
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410616 135083416 2 H4N5O6C8 A4B5C6D8 135.38 1.6 -11.37 -2.96 0
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410617 135083417 2 N4O6H7C8 A4B6C7D8 38.41 8.33 -10.59 -2.5 0
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410618 135083418 1 N8H12O12C15 A8B12C12D15 48.54 3.63 -11.3 -2.74 0
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410619 135083419 1 N8O8H14C17 A8B8C14D17 102.44 8.3 -10.74 -2.34 0
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410620 135083420 1 Cl2N6O8H12C15 A2B6C8D12E15 28.32 7.24 -10.22 -2.29 0
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410621 135083421 1 N6O8C17H18 A6B8C17D18 27.61 13.03 -10.45 -1.93 0
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410622 135083422 1 Cl2N8H10O12C15 A2B8C10D12E15 37.17 5.47 -10.76 -2.98 0
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410623 135083423 1 FN9C10O14H16 AB9C10D14E16 -52.09 6.57 -11.2 -2.56 0
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410624 135083424 1 FN9C11O14H18 AB9C11D14E18 -56.95 6.09 -11.06 -2.54 0
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410625 135083425 1 Cl2N8O8H10C17 A2B8C8D10E17 109.41 5.09 -10.78 -2.7 0
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410626 135083426 2 NOC7H7 ABC7D7 39.52 5.04 -9.38 -0.53 -1
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410628 135083428 1 ZrC21H26 AB21C26 79.49 0.37 -6.14 -0.52 -1
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410630 135083430 1 OZrC22H33 ABC22D33 115.89 2.75 0.0 0.0 0
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410631 135083431 1 HfC14H18 AB14C18 25.31 3.8 -7.92 -2.21 -1
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410632 135083432 1 ZrC23H32 AB23C32 143.23 2.84 -5.89 -0.91 -1
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410633 135083433 1 ZrC28H34 AB28C34 48.7 1.55 -6.69 -1.61 -1
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410634 135083434 1 ZrC22H30 AB22C30 24.28 1.02 -6.95 -1.57 0
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410635 135083435 1 LiOC6H9 ABC6D9 -1.6 20.0 -6.27 -0.22 0
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410636 135083436 1 LiOC8H11 ABC8D11 -53.78 5.73 -7.68 2.42 0
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410637 135083438 1 LiOC9H13 ABC9D13 -68.97 5.53 -7.63 2.51 0
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410638 135083439 1 OC9H14 AB9C14 -48.41 0.59 -8.88 1.3 0
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410639 135083440 1 LiOC11H17 ABC11D17 -85.85 5.55 -7.64 2.53 0
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410640 135083441 1 OC11H18 AB11C18 -21.39 1.58 -7.86 0.37 0
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410641 135083442 1 LiOC10H13 ABC10D13 -58.79 6.36 -7.36 1.31 0
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410642 135083443 1 OC10H14 AB10C14 -42.95 3.35 -8.42 0.47 -4
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410643 135083444 1 SP3N6O16C20H29 AB3C6D16E20F29 -624.8 3.82 -9.47 -2.25 0
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410644 135083445 1 SP3N6O16C20H33 AB3C6D16E20F33 -863.88 5.54 -9.42 -0.89 0
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410645 135083446 1 ClNOC6H14 ABCD6E14 -64.32 2.25 -10.04 1.5 0
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410648 135083449 1 CrPSO3H21C27 ABCD3E21F27 165.09 1.82 -7.74 -0.97 0
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410649 135083450 1 PSH21C24 ABC21D24 88.07 1.69 -8.39 0.13 0
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410650 135083451 1 CrNPO3H22C27 ABCD3E22F27 71.1 3.11 -7.34 0.14 0
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410651 135083452 1 NPH22C24 ABC22D24 82.66 2.98 -8.49 0.04 0
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410652 135083453 1 CrNPO3H24C28 ABCD3E24F28 84.57 3.73 -7.94 -0.8 0
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410653 135083454 1 NPH24C25 ABC24D25 83.56 2.59 -8.38 0.17 0
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410654 135083455 1 CrPO4H21C28 ABC4D21E28 8.93 1.96 -7.84 0.06 0
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410655 135083456 1 CrNPO3H24C25 ABCD3E24F25 42.75 3.49 -8.35 -0.4 0
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410656 135083457 1 ClCrPO3H18C23 ABCD3E18F23 71.42 3.37 -7.67 -0.31 0
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410657 135083458 1 ClPH18C20 ABC18D20 45.19 3.16 -8.66 -0.1 0
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410658 135083459 1 BrSiH18C43F63 ABC18D43E63 -3131.0 2.89 -9.92 -1.09 -1