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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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387516 134985663 2 OC5H8 AB5C8 -66.83 1.76 -8.14 0.74 0
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387517 134985671 2 PO3C4H10 AB3C4D10 -394.17 3.77 -10.59 0.78 0
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387518 134985672 1 Se3C12H16 A3B12C16 23.71 3.33 -8.14 -0.41 0
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387519 134985673 1 NPSO4C11H22 ABCD4E11F22 -249.76 5.42 -8.88 -0.15 0
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387520 134985675 2 SC7H10 AB7C10 -9.37 1.79 -8.46 0.07 1
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387521 134985679 1 N2O3H7C8 A2B3C7D8 -53.41 5.32 0.0 0.0 0
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387522 134985697 1 OSiC16H24 ABC16D24 -32.06 1.67 -8.69 0.33 0
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387523 134985704 1 SC9H16 AB9C16 -13.94 1.23 -8.26 0.73 0
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387524 134985711 1 NO3C12H13 AB3C12D13 -96.5 5.22 -9.64 -0.44 0
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387525 134985714 2 OC6H12 AB6C12 -142.42 3.16 -9.55 0.92 0
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387526 134985716 1 ON2C12H16 AB2C12D16 28.48 4.49 -9.08 -0.22 0
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387527 134985720 1 BrN2O3C10H15 AB2C3D10E15 -60.86 7.02 -10.35 -1.26 0
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387528 134985723 1 OC13H18 AB13C18 -29.07 1.77 -8.59 0.45 0
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387529 134985729 1 O2C11H20 A2B11C20 -108.26 0.7 -9.07 1.25 0
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387530 134985730 1 BOSF4C6H13 ABCD4E6F13 -397.81 11.43 -9.46 -0.57 0
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387531 134985738 1 BrH2C3Cl3 AB2C3D3 9.15 1.46 -10.65 -1.07 0
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387532 134985741 1 N2F6C9H12 A2B6C9D12 -313.49 1.9 -9.64 -0.52 1
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387533 134985743 1 O2N3C12H22 A2B3C12D22 -41.3 2.73 0.0 0.0 0
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387534 134985748 1 N2O2C11H14 A2B2C11D14 -22.52 2.22 -9.41 0.03 0
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387535 134985749 1 O2C13H18 A2B13C18 -88.98 4.46 -9.12 0.04 0
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387536 134985756 1 O2C11H14 A2B11C14 -60.11 2.44 -9.34 0.29 0
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387537 134985757 1 SC13H18 AB13C18 9.19 0.78 -8.48 0.24 0
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387538 134985759 1 SO2C8H12 AB2C8D12 -77.52 6.04 -9.12 -1.21 0
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387539 134985760 1 SO2C8H12 AB2C8D12 -76.58 4.45 -9.11 -1.13 0
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387540 134985765 1 BrNO2C10H12 ABC2D10E12 -46.63 3.12 -8.85 -0.44 0
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387541 134985771 1 OSCl2C10H12 ABC2D10E12 -53.76 1.89 -8.93 -0.61 0
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387542 134985787 1 SO2C4F10 AB2C4D10 -584.18 3.05 -10.79 -1.66 0
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387543 134985794 1 ClNSC9H10 ABCD9E10 24.67 3.14 -8.62 -0.57 0
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387544 134985796 1 ClFSiC10H18 ABCD10E18 -94.15 2.93 -9.63 0.86 0
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387545 134985797 1 OSC8H12 ABC8D12 -33.04 2.33 -8.51 0.17 0
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387546 134985800 1 OC14H14 AB14C14 -8.29 4.03 -9.18 -0.2 0
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387547 134985801 1 BrFC7H12 ABC7D12 -73.92 2.85 -10.65 -0.43 0
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387548 134985803 1 OC7H12 AB7C12 -15.86 1.54 -9.6 1.1 0
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387549 134985804 1 N2O2C13H18 A2B2C13D18 -32.07 2.39 -8.72 -0.48 0
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387550 134985810 1 NO3C12H15 AB3C12D15 -59.61 3.24 -8.28 -0.31 0
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387551 134985813 1 O2N3C13H15 A2B3C13D15 -32.81 1.12 -8.55 -0.37 0
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387552 134985814 1 N2O2S2C11H14 A2B2C2D11E14 -20.05 4.6 -8.53 -0.6 0
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387553 134985816 1 N6C11H14 A6B11C14 123.97 6.34 -8.86 -0.58 0
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387554 134985831 1 NSO2C11H13 ABC2D11E13 -18.21 6.43 -7.59 -0.6 0
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387555 134985841 1 SN3O3C11H13 AB3C3D11E13 -41.3 3.63 -9.87 -0.55 1
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387556 134985843 1 N2O2C12H13 A2B2C12D13 7.47 5.03 0.0 0.0 0
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387557 134985845 2 OC5H10 AB5C10 -134.09 4.17 -10.2 0.5 0
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387558 134985855 1 O3C10H18 A3B10C18 -143.51 1.28 -9.4 0.66 0
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387559 134985857 1 SO2C7H10 AB2C7D10 -78.15 3.05 -9.17 -1.14 0
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387560 134985871 1 OS2C11H14 AB2C11D14 -30.42 1.58 -8.87 -0.02 0
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387561 134985872 1 SbSe2C5Cl6H11 AB2C5D6E11 -111.94 17.19 -9.91 -2.98 0
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387562 134985877 1 NO2C15H19 AB2C15D19 -63.34 3.42 -9.49 0.25 0
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387563 134985878 1 C13H18 A13B18 10.4 0.4 -9.24 0.48 1
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387564 134985886 1 SO2N3C10H10 AB2C3D10E10 22.31 4.51 0.0 0.0 0
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387565 134985887 1 NOSC15H19 ABCD15E19 -9.05 2.64 -8.48 -0.5 0
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387566 134985890 2 OSH5C7 ABC5D7 -14.53 0.55 -8.1 -1.9 0
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387567 134985891 1 NO3C11H13 AB3C11D13 -64.43 6.31 -9.91 -0.4 0
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387568 134985892 1 NO3C14H21 AB3C14D21 -147.11 3.27 -8.85 0.2 0
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387569 134985894 1 NO3C12H17 AB3C12D17 -135.15 3.11 -8.94 0.03 0
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387570 134985895 2 OC8H9 AB8C9 -46.55 0.95 -8.57 0.01 0
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387571 134985898 1 PCl2O2C9H11 AB2C2D9E11 -116.83 6.69 -9.15 -0.32 0
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387572 134985899 1 PC12H25 AB12C25 -48.26 1.34 -8.35 1.12 0
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387573 134985907 1 BrIC8H12 ABC8D12 10.52 2.59 -9.64 -1.18 0
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387574 134985910 1 FSC11H13 ABC11D13 -23.4 2.93 -8.7 -0.21 0
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387575 134985930 1 OCl2N2H6C9 AB2C2D6E9 30.65 2.84 -9.98 -1.28 0
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387576 134985962 1 ClIH8C9 ABC8D9 52.27 1.83 -9.51 -1.39 0
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387577 134985964 2 NSH5C6 ABC5D6 106.07 4.87 -8.54 -0.94 0
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387578 134985970 1 SN3O4C8H13 AB3C4D8E13 -105.74 5.52 -8.83 -0.56 1
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387579 134985971 1 SN3O4C8H14 AB3C4D8E14 -98.79 7.69 0.0 0.0 0
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387580 134985972 1 PN2O3C11H13 AB2C3D11E13 -113.54 2.99 -8.97 -0.17 0
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387581 134985976 1 NSiO2C12H27 ABC2D12E27 -145.97 3.43 -8.52 1.32 0
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387582 134985982 1 NSC11H17 ABC11D17 -6.59 2.76 -8.19 0.26 0
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387583 134985983 1 NaON4H7C8 ABC4D7E8 31.91 9.04 -7.84 0.08 0
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387584 134985984 1 SSiC11H16 ABC11D16 2.61 1.16 -8.34 -0.04 0
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387585 134985986 1 SC10H20 AB10C20 -23.18 2.57 -8.41 0.78 0
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387586 134986008 1 NO2C12H15 AB2C12D15 -28.88 1.28 -8.48 -0.28 1
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387587 134986011 1 ON2C14H19 AB2C14D19 -5.19 3.67 0.0 0.0 0
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387588 134986012 1 NOC14H21 ABC14D21 -10.74 0.9 -9.48 0.22 0
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387589 134986014 1 OC16H16 AB16C16 16.29 1.82 -8.55 -0.03 0
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387590 134986021 1 BrO3C9H11 AB3C9D11 -72.47 3.72 -9.92 -1.04 0