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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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403671 135061233 1 O3N4C27H34 A3B4C27D34 -44.9 3.51 -9.07 -0.23 0
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403672 135061245 1 ON2C16H16 AB2C16D16 8.51 1.57 -8.95 -0.43 0
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403673 135061249 1 OC24H36 AB24C36 -53.95 3.06 -9.07 0.56 0
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403674 135061261 1 FSO2C14H17 ABC2D14E17 -116.79 1.74 -9.09 -0.43 0
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403675 135061263 1 FNC16H16 ABC16D16 -5.53 2.26 -9.19 0.08 0
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403676 135061305 3 OSC9H10 ABC9D10 -61.11 6.53 -8.37 -0.09 0
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403677 135061347 1 NO3C15H17 AB3C15D17 -54.31 3.35 -9.51 -0.8 0
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403678 135061351 1 NOC15H25 ABC15D25 -29.19 4.09 -8.78 0.48 0
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403681 135061354 1 O5C24H30 A5B24C30 -180.94 1.99 -8.49 -0.55 0
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403682 135061356 1 NOSiF7C25H32 ABCD7E25F32 -398.67 7.46 -9.27 -1.53 0
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403683 135061357 2 GeC8H18 AB8C18 -53.76 0.54 -9.26 1.39 0
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403684 135061358 1 SiC23H32 AB23C32 3.23 0.78 -9.18 0.42 0
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403685 135061359 1 F2O2H12C15 A2B2C12D15 -128.84 4.61 -8.97 -0.72 0
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403686 135061360 1 O2C17H18 A2B17C18 -44.1 4.92 -8.85 -0.22 0
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403688 135061364 1 BNSSiO4C27H38 ABCDE4F27G38 -236.92 4.09 -9.0 -0.34 0
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403689 135061365 1 BSiO2C42H43 ABC2D42E43 -63.57 3.56 -8.74 0.22 1
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403691 135061370 1 NSiC14H25 ABC14D25 -24.29 1.8 -8.02 0.42 0
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403692 135061372 1 BSiO2N3C24H44 ABC2D3E24F44 -162.68 3.84 -7.88 0.45 0
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403693 135061373 1 ON2H18C21 AB2C18D21 42.41 3.12 -9.01 -0.46 0
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403694 135061374 1 O2F3N3H20C24 A2B3C3D20E24 -155.27 2.8 -8.36 -1.23 0
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403695 135061375 1 ON3H11C14 AB3C11D14 90.73 2.87 -9.03 -1.25 0
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403696 135061376 1 ClON3H10C14 ABC3D10E14 85.93 2.86 -9.15 -1.44 0
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403697 135061377 1 BO3C14H19 AB3C14D19 -163.0 4.28 -9.35 0.04 0
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403698 135061441 1 OS2C20H34 AB2C20D34 -71.34 3.63 -8.56 0.0 0
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403699 135061445 1 OSiS2C16H36 ABC2D16E36 -152.3 2.52 -8.58 0.47 0
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403700 135061463 1 C17H20 A17B20 29.01 0.27 -8.7 0.57 0
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403701 135061465 1 FO3H21C26 AB3C21D26 -82.98 4.16 -8.36 -0.34 0
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403702 135061472 1 N2C25H26 A2B25C26 67.29 5.01 -8.41 -0.18 0
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403703 135061477 1 SN2O4H14C19 AB2C4D14E19 -32.45 6.07 -9.35 -1.28 0
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403704 135061484 1 ClNC19H28 ABC19D28 -20.74 4.0 -7.83 -0.11 0
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403705 135061485 1 NO3H19C22 AB3C19D22 32.73 6.5 -9.61 -1.16 0
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403706 135061486 1 NO3H19C22 AB3C19D22 36.37 6.06 -9.28 -1.48 0
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403707 135061487 1 OH18C21 AB18C21 47.4 2.21 -9.15 -0.09 0
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403708 135061489 1 BO4C15H29 AB4C15D29 -304.37 4.0 -10.23 1.09 0
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403709 135061491 1 BO4C15H29 AB4C15D29 -303.43 3.77 -10.24 1.07 0
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403710 135061492 1 B2O4C21H34 A2B4C21D34 -343.92 4.41 -8.94 0.76 0
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403711 135061493 2 BO2C10H19 AB2C10D19 -384.13 3.99 -9.95 1.82 0
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403712 135061494 1 B2O5C19H36 A2B5C19D36 -439.91 4.62 -9.75 1.43 0
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403713 135061495 1 BSO2C17H27 ABC2D17E27 -165.9 3.5 -8.84 0.16 0
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403714 135061496 1 ON2C24H24 AB2C24D24 23.49 4.37 -8.67 0.12 0
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403715 135061497 1 Si3O4C16H38 A3B4C16D38 -420.97 1.63 -9.41 1.04 0
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403716 135061498 1 BO4C22H27 AB4C22D27 -223.28 1.44 -9.16 0.16 0
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403717 135061499 1 BO4C22H29 AB4C22D29 -248.32 2.82 -8.56 -0.13 0
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403718 135061500 1 ClNO5C22H30 ABC5D22E30 -256.92 0.92 -9.65 -0.28 0
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403719 135061502 1 N2S2O4H18C21 A2B2C4D18E21 -18.01 6.16 -10.14 -0.89 0
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403720 135061504 1 NS2O6H21C22 AB2C6D21E22 -136.93 8.14 -9.86 -0.89 0
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403721 135061506 1 NSF3O4C29H30 ABC3D4E29F30 -238.95 5.31 -8.54 -0.35 0
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403722 135061507 1 BO4C20H31 AB4C20D31 -275.83 1.08 -8.97 0.56 0
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403723 135061508 1 NOPC22H22 ABCD22E22 6.78 3.75 -9.28 -0.19 0
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403724 135061509 1 NPO2C23H24 ABC2D23E24 -32.03 2.51 -8.7 -0.12 0
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403725 135061510 1 N3O7C30H41 A3B7C30D41 -306.08 2.21 -9.46 0.1 0
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403726 135061513 1 S2O8C23H24 A2B8C23D24 -251.83 7.19 -9.91 -0.67 0
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403727 135061515 1 C17H26 A17B26 16.75 0.89 -8.65 0.45 0
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403728 135061526 1 NOC21H31 ABC21D31 -56.63 6.71 -8.49 -0.16 0
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403729 135061533 1 FON2H21C22 ABC2D21E22 -10.51 0.72 -8.45 -0.81 0
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403730 135061559 1 NSO3C26H27 ABC3D26E27 -36.21 7.62 -8.42 -0.54 0
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403731 135061564 1 NOH17C18 ABC17D18 27.75 2.08 -9.42 0.15 0
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403732 135061632 1 S2O3C26H30 A2B3C26D30 -39.1 7.04 -8.02 -0.26 0
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403733 135061633 1 S2O3C22H26 A2B3C22D26 -9.5 6.51 -8.28 -0.28 0
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403734 135061634 1 O2C21H26 A2B21C26 -47.67 2.14 -9.32 0.16 1
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403735 135061635 1 N2C20H25 A2B20C25 39.67 2.09 0.0 0.0 0
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403736 135061637 1 NO2C31H31 AB2C31D31 -24.12 1.96 -9.03 -0.06 0
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403737 135061638 1 O3C18H20 A3B18C20 -68.17 2.04 -9.23 -0.33 2
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403738 135061639 3 NC7H9 AB7C9 78.3 1.92 -7.78 -0.2 0
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403739 135061641 1 NSiC15H27 ABC15D27 -12.72 3.74 -9.88 1.01 0
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403740 135061642 1 SiN2O2C20H26 AB2C2D20E26 -53.76 1.78 -8.57 -0.09 0
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403741 135061643 2 FN2H12C14 AB2C12D14 24.3 5.05 -8.02 -0.19 0
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403742 135061645 1 O2N3C13H15 A2B3C13D15 -30.65 6.45 -9.43 -1.06 0
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403743 135061646 1 N3O3C20H23 A3B3C20D23 -68.27 5.78 -9.01 -0.56 0
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403744 135061647 1 FN3H12C14 AB3C12D14 32.14 3.31 -8.52 -0.52 0
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403745 135061648 1 SO2N3C22H29 AB2C3D22E29 -37.33 6.31 -8.12 -0.93 0
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403746 135061649 1 SN3O3H19C21 AB3C3D19E21 -11.79 5.67 -8.27 -0.94 0
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403747 135061650 1 SO2N4H12C16 AB2C4D12E16 44.41 5.51 -8.94 -0.71 0
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403748 135061651 1 ClON2C13H15 ABC2D13E15 -13.62 1.05 -9.16 -0.82 0
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403749 135061652 1 ClSN3H12C17 ABC3D12E17 103.78 2.77 -8.35 -0.85 0
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403750 135061653 1 O2N3H15C16 A2B3C15D16 -1.66 6.48 -8.97 -0.7 0
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403751 135061654 1 NO4C16H19 AB4C16D19 -155.84 5.33 -8.94 -0.6 0
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403752 135061655 1 NO2C16H21 AB2C16D21 -92.25 3.23 -8.58 0.31 0
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403753 135061656 1 OC22H30 AB22C30 -45.79 1.54 -8.53 0.3 0
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403754 135061670 1 NOC15H19 ABC15D19 -41.61 2.41 -8.66 0.01 0
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403755 135061671 1 ON2H18C20 AB2C18D20 39.12 3.65 -8.45 -0.02 0
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403756 135061675 1 ClOH15C20 ABC15D20 43.14 0.79 -8.8 -0.79 0
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403757 135061676 1 ClOH15C20 ABC15D20 42.87 4.54 -8.66 -0.66 0
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403758 135061710 1 ON2F6C16H16 AB2C6D16E16 -325.8 9.85 -9.31 -0.85 0
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403759 135061725 1 BrOSiC15H17 ABCD15E17 -24.66 1.54 -9.16 -0.12 0
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403760 135061732 1 OSiC23H38 ABC23D38 -86.59 1.91 -9.13 0.45 0
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403761 135061773 1 NO8C11H15 AB8C11D15 -257.87 5.59 -11.18 -1.33 0
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403762 135061774 1 OC13H20 AB13C20 -54.66 3.72 -9.49 0.42 0
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403763 135061775 1 OC12H18 AB12C18 -60.63 4.08 -9.74 0.17 0
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403764 135061776 1 NSO4C15H21 ABC4D15E21 -163.63 5.92 -9.59 -0.61 0
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403765 135061777 1 NSO4C15H21 ABC4D15E21 -159.24 3.69 -9.51 -0.6 0
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403766 135061778 1 BrSeN5O5H14C16 ABC5D5E14F16 -78.35 4.77 -9.62 -1.31 0
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403767 135061779 1 ISeN2Si2O7C28H41 ABC2D2E7F28G41 -380.88 9.87 -8.98 -1.14 0
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403768 135061780 1 ISeN5O5H14C16 ABC5D5E14F16 -62.86 5.32 -9.45 -1.52 0
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403769 135061782 1 O3C16H24 A3B16C24 -115.64 0.94 -9.1 0.23 0
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403770 135061783 1 OS2C14H18 AB2C14D18 -32.39 1.05 -8.65 0.19 2
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403771 135061785 1 N3C23H31 A3B23C31 64.92 2.18 -7.66 -0.08 0
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403772 135061786 1 NO2H25C30 AB2C25D30 36.91 3.12 -8.25 -0.01 2
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403773 135061787 1 N3C32H41 A3B32C41 74.82 1.49 -7.64 -0.2 0
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403774 135061789 1 ClFSN3O4H17C20 ABCD3E4F17G20 -130.38 7.39 -8.79 -1.03 0