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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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411740 135084574 2 NOC13H14 ABC13D14 6.83 2.48 -8.63 -0.62 0
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411741 135084575 1 OSN5C41H41 ABC5D41E41 82.73 7.78 -8.22 -0.76 0
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411742 135084576 1 RhN2O7C30H32 AB2C7D30E32 -224.64 16.76 0.0 0.0 0
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411743 135084577 2 RhH4O4C9F14 AB4C4D9E14 -1758.91 17.34 -9.51 -6.04 0
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411745 135084579 2 AuClOPC21H28 ABCDE21F28 -147.24 9.82 -8.72 -2.13 0
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411746 135084580 1 PI4O5H25C31 AB4C5D25E31 -99.29 3.32 -8.09 -1.09 0
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411748 135084582 2 AuClPO4C37H51 ABCD4E37F51 -294.61 30.55 -6.6 -1.84 0
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411749 135084583 2 NOC17H18 ABC17D18 -1.83 0.85 -8.81 -0.76 0
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411750 135084584 1 TiN4C12H20 AB4C12D20 16.95 4.95 -8.46 -1.05 -2
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411751 135084585 1 ClNiP2N3C38H39 ABC2D3E38F39 107.28 7.23 0.0 0.0 0
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411752 135084586 1 P2N3C38H41 A2B3C38D41 106.74 2.78 -7.44 -0.61 1
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411753 135084587 1 BNOC9H13 ABCD9E13 -40.89 7.42 0.0 0.0 0
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411754 135084588 2 ORhC4H9 ABC4D9 -150.0 9.72 -9.96 -6.51 -1
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411755 135084589 1 BN2O2C16H18 AB2C2D16E18 -67.78 7.01 0.0 0.0 0
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411756 135084590 1 BN2O2C16H19 AB2C2D16E19 -88.05 5.19 -7.81 -0.66 0
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411758 135084592 1 IrON3C32H48 ABC3D32E48 42.59 32.23 -9.18 -3.8 0
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411759 135084593 1 IrON3C32H48 ABC3D32E48 43.91 30.66 -9.23 -3.84 0
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411760 135084594 1 SiN2O6C32H44 AB2C6D32E44 -241.83 2.15 -8.89 -0.54 2
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411761 135084595 1 PdN2P2F5H29C38 AB2C2D5E29F38 4.89 6.85 -6.84 -1.2 0
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411762 135084596 6 NC7H9 AB7C9 122.77 6.19 -7.63 0.04 0
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411763 135084597 1 PC27H27 AB27C27 82.62 1.52 -8.61 0.13 0
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411764 135084598 2 C3O3H4 A3B3C4 -232.22 4.25 -10.5 -1.47 0
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411765 135084599 1 NNaO3H6C7 ABC3D6E7 -47.14 6.33 -8.45 -1.04 0
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411766 135084600 1 BrO2C12H15 AB2C12D15 -57.24 1.65 -8.73 0.11 0
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411767 135084601 2 OC5H11 AB5C11 -137.29 1.06 -9.98 2.39 0
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411768 135084602 1 F2O2C13H14 A2B2C13D14 -167.69 2.72 -9.43 -0.24 0
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411769 135084603 1 BrNSO2C12H14 ABCD2E12F14 -9.11 6.13 -9.36 -1.22 0
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411770 135084604 1 OSC13H16 ABC13D16 18.01 1.43 -7.96 0.14 0
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411771 135084605 1 OC10H16 AB10C16 -26.67 2.23 -9.64 1.88 0
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411772 135084606 1 FNOSC11H12 ABCDE11F12 -59.12 2.32 -8.16 -0.05 3
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411773 135084618 1 O3N6C25H35 A3B6C25D35 -60.16 6.59 0.0 0.0 2
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411774 135084619 1 ON4C17H24 AB4C17D24 5.13 3.44 -6.48 0.13 0
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411776 135084621 2 NOCl2C13H14 ABC2D13E14 -59.62 4.88 -9.04 -0.68 0
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411777 135084622 1 ClSN2O5C35H37 ABC2D5E35F37 -110.06 12.85 -7.97 -1.18 -1
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411779 135084624 1 RhF6C24H36 AB6C24D36 -215.74 7.35 0.0 0.0 6
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411781 135084626 1 PPdCl2N2H16C17 ABC2D2E16F17 165.25 5.13 0.0 0.0 4
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411782 135084627 1 NiO2P2N3C53H59 AB2C2D3E53F59 250.07 27.6 -4.59 -1.07 0
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411783 135084628 1 NOPH18C22 ABCD18E22 46.93 1.73 -8.62 -0.6 1
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411784 135084629 1 OPN2C23H26 ABC2D23E26 17.27 3.88 0.0 0.0 -1
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411785 135084630 1 ClRhP2O5H28C36 ABC2D5E28F36 121.91 23.24 -9.24 -5.84 0
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411786 135084631 1 FePC26H43 ABC26D43 223.85 4.14 -6.44 -3.55 -1
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411788 135084633 1 Rh2N4O12C24H37 A2B4C12D24E37 -417.38 3.6 0.0 0.0 0
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411789 135084634 2 N2O6C12H19 A2B6C12D19 -436.47 2.11 -9.38 0.14 1
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411790 135084635 1 P2Rh2O4F6H45C46 A2B2C4D6E45F46 -450.25 43.72 0.0 0.0 0
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411791 135084636 2 C2H2O2F3 A2B2C2D3 -427.52 1.32 -11.26 -1.9 1
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411792 135084637 1 P2H41C42 A2B41C42 97.08 7.1 0.0 0.0 -1
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411793 135084638 1 Rh2F4N4O12H41C44 A2B4C4D12E41F44 -414.57 7.97 0.0 0.0 0
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411794 135084639 2 F2N2O6H21C22 A2B2C6D21E22 -449.85 4.91 -9.6 -0.49 0
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411795 135084640 1 PdC2S2H4F6O8 AB2C2D4E6F8 -629.06 10.84 -10.28 -1.56 1
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411796 135084641 1 N2C23H39 A2B23C39 4.33 1.14 0.0 0.0 3
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411797 135084642 1 AgN2C14H14 AB2C14D14 -66.34 14.9 0.0 0.0 2
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411798 135084643 2 AuClPO3C37H53 ABCD3E37F53 -254.61 19.46 -8.45 -1.15 0
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411799 135084644 1 InN2Cl4C8H15 AB2C4D8E15 -143.02 15.32 -10.36 -1.24 0
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411800 135084645 1 RuN3C11H14 AB3C11D14 191.18 10.0 0.0 0.0 0
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411801 135084646 1 O4N5C49H55 A4B5C49D55 -28.14 2.45 -8.66 -0.87 -1
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411803 135084648 1 PdCl4N4C35H66 AB4C4D35E66 -88.66 2.85 -7.67 -3.48 0
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411804 135084649 1 ClOSH11C14 ABCD11E14 -1.3 0.72 -9.06 -0.45 0
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411805 135084650 1 BrFOH6C9 ABCD6E9 -6.62 2.74 -9.01 -0.64 0
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411806 135084651 1 OC14H20 AB14C20 8.14 1.07 -10.23 1.37 0
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411807 135084652 1 ClNOC12H12 ABCD12E12 -10.87 3.47 -9.11 -0.82 0
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411808 135084653 1 IOC15H15 ABC15D15 70.17 0.87 -8.61 -0.86 0
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411809 135084654 1 ON3C11H13 AB3C11D13 66.99 4.88 -9.97 -0.59 0
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411810 135084655 1 FOSiC11H17 ABCD11E17 -142.75 3.59 -9.26 0.13 0
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411811 135084656 1 OC16H18 AB16C18 18.78 2.59 -9.21 0.34 0
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411812 135084657 1 BrO4C11H11 AB4C11D11 -122.76 3.13 -9.91 -0.68 0
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411813 135084658 1 ON3H7C12 AB3C7D12 116.06 1.55 -8.65 -1.61 0
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411814 135084659 1 O2S2C9H10 A2B2C9D10 -18.14 3.12 -8.74 -0.93 0
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411815 135084660 1 N2O2C15H26 A2B2C15D26 -114.41 4.25 -9.12 1.22 -2
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411817 135084662 1 PdO4C5H12 AB4C5D12 -164.64 6.35 -7.65 0.54 0
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411818 135084663 2 PPdO2C17H23 ABC2D17E23 -64.16 13.17 -6.08 0.13 0
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411819 135084664 1 PC33H45 AB33C45 -32.39 1.23 -8.14 0.45 0
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411820 135084665 1 CuCl4N4H24C44 AB4C4D24E44 411.5 4.56 0.0 0.0 0
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411823 135084668 1 VN2O3C45H74 AB2C3D45E74 -207.44 9.55 0.0 0.0 0
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411824 135084669 1 N2O2C45H74 A2B2C45D74 -156.25 4.91 -7.98 -0.5 1
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411825 135084670 1 N2O2F3C28H30 A2B2C3D28E30 -147.86 5.03 0.0 0.0 3