List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
311621 126595691 1 O2N3H29C44 A2B3C29D44 144.5 3.73 -7.86 -1.08 0
311622 126595694 1 N7H29C52 A7B29C52 357.66 6.32 -7.88 -1.51 0
311623 126595697 1 N7H25C46 A7B25C46 334.39 6.49 -7.91 -1.51 0
311624 126595703 1 N5H67C92 A5B67C92 373.59 2.02 -7.78 -0.76 0
311625 126595739 1 SO3N5C25H37 AB3C5D25E37 -104.6 9.49 -8.65 -0.36 0
311626 126595806 1 OSN5C27H41 ABC5D27E41 -12.97 8.14 -8.45 -0.35 0
311628 126595859 1 IO9C23H33 AB9C23D33 -385.29 4.79 -10.04 -1.27 0
311629 126595863 3 N3H23C33 A3B23C33 494.53 1.39 -7.76 -0.88 0
311630 126595869 2 FO2H7C9 AB2C7D9 -174.28 1.02 -8.97 -0.89 0
311631 126595872 2 N2O3C10H17 A2B3C10D17 -253.77 5.02 -9.59 -0.12 0
311632 126595876 1 FON2C19H27 ABC2D19E27 -73.23 3.25 -8.73 -0.07 0
311633 126595878 1 O3N7C19H21 A3B7C19D21 3.64 4.75 -8.67 -0.4 0
311634 126595885 2 N3O4C24H42 A3B4C24D42 -403.54 5.14 -8.38 0.28 0
311635 126595886 1 SN7O7C49H83 AB7C7D49E83 -322.47 7.21 -8.27 -1.0 0
311636 126595903 3 N2O3C15H26 A2B3C15D26 -435.55 8.89 -9.12 0.32 0
311637 126595912 1 NOC11H17 ABC11D17 -32.16 2.85 -7.86 0.65 0
311638 126596027 1 OSN5C20H21 ABC5D20E21 63.79 6.74 -8.36 -0.5 0
311639 126596233 1 SN3H27C41 AB3C27D41 207.01 6.14 -8.49 -1.09 0
311640 126596235 1 SN3H31C42 AB3C31D42 203.99 4.57 -8.1 -0.96 0
311641 126596618 1 NC19H41 AB19C41 -90.25 1.53 -8.72 3.15 0
311643 126596711 1 N2O8C29H36 A2B8C29D36 -321.42 7.4 -8.91 -0.86 0
311644 126596722 1 O2N3H23C38 A2B3C23D38 158.11 3.27 -8.22 -1.07 0
311645 126596729 1 SN3H29C44 AB3C29D44 224.68 2.69 -8.2 -0.92 0
311647 126596829 1 ON3H23C33 AB3C23D33 145.51 7.92 -8.53 -0.89 0
311648 126596830 1 ON3H27C43 AB3C27D43 194.37 2.63 -8.0 -0.97 0
311649 126596831 1 INOH18C30 ABCD18E30 126.39 2.42 -8.3 -1.11 0
311650 126596832 1 ON2H20C30 AB2C20D30 102.3 3.95 -8.18 -0.5 0
311651 126596833 1 ON2H24C32 AB2C24D32 178.55 6.17 -8.06 -0.95 0
311653 126596837 1 SN3H33C43 AB3C33D43 279.69 8.79 -6.9 -1.44 0
311654 126596838 1 ClO2N5H22C28 AB2C5D22E28 32.18 7.15 -8.38 -1.09 0
311655 126596839 1 PN4O10C18H23 AB4C10D18E23 -337.66 4.12 -9.46 -1.94 0
311656 126596840 1 PN4O8C18H23 AB4C8D18E23 -332.89 5.91 -9.96 -1.94 0
311657 126596841 1 ClO2N4H23C24 AB2C4D23E24 10.05 3.39 -9.24 -0.89 0
311658 126596842 1 BrNO2C9H12 ABC2D9E12 -77.62 2.54 -8.63 -0.51 0
311659 126596843 1 ON3H27C44 AB3C27D44 193.75 3.44 -8.29 -0.8 0
311660 126596844 1 ON3H21C30 AB3C21D30 102.15 5.57 -7.97 -0.58 0
311661 126596845 1 ON3H29C42 AB3C29D42 164.88 2.79 -7.87 -0.61 0
311662 126596846 1 ON2H24C30 AB2C24D30 93.96 1.83 -7.9 -0.39 0
311663 126596847 1 ON3H33C43 AB3C33D43 141.11 4.65 -7.82 -0.42 0
311664 126596849 1 ON3H29C32 AB3C29D32 84.83 4.51 -7.76 -0.34 0
311665 126596850 1 ON2H22C32 AB2C22D32 148.07 5.03 -8.32 -1.01 0
311666 126596851 1 ON2H18C31 AB2C18D31 248.78 3.28 -8.46 -1.04 0
311667 126596852 1 ON2H20C31 AB2C20D31 138.23 3.22 -8.38 -0.85 0
311668 126596853 1 ON2H20C30 AB2C20D30 102.64 2.98 -8.12 -0.63 0
311669 126596854 1 O2N3H27C44 A2B3C27D44 266.15 6.06 -8.34 -1.07 0
311670 126596855 1 NSC12H23 ABC12D23 -29.3 2.85 -8.88 0.48 0
311671 126596856 1 O2N3H25C44 A2B3C25D44 206.96 2.61 -8.57 -1.1 0
311672 126596857 1 S2N3H23C38 A2B3C23D38 217.93 6.55 -8.45 -1.13 0
311673 126596858 1 ON3H39C45 AB3C39D45 189.64 7.74 -7.77 -0.83 0
311674 126596859 1 ON3H29C44 AB3C29D44 190.45 3.66 -8.32 -1.01 0
311675 126596860 1 ON3H35C43 AB3C35D43 153.85 4.87 -7.61 -0.39 0
311676 126596861 1 ON3H33C44 AB3C33D44 203.51 3.01 -7.97 -0.43 0
311677 126596862 1 ON2H24C38 AB2C24D38 171.51 4.72 -8.43 -0.89 0
311678 126596863 1 ON2H26C37 AB2C26D37 161.18 4.93 -8.18 -0.72 0
311679 126596864 1 ON2H22C31 AB2C22D31 143.33 3.75 -8.08 -0.8 0
311680 126596865 1 INC10H22 ABC10D22 -30.87 2.45 -8.88 -0.7 0
311682 126596868 1 OSCl2F6H18C30 ABC2D6E18F30 -241.78 4.23 -8.87 -1.05 0
311683 126596869 1 OSC25H44 ABC25D44 -108.62 3.77 -8.6 -0.66 0
311684 126596870 1 ClF2N4O5H29C31 AB2C4D5E29F31 -183.19 11.69 -7.93 -1.14 0
311685 126596871 1 F2N4O4H30C31 A2B4C4D30E31 -200.1 6.22 -8.94 -0.64 0
311686 126596872 1 BrFN4O4H30C31 ABC4D4E30F31 -148.51 7.62 -9.29 -0.78 0
311687 126596873 1 N4O5C25H30 A4B5C25D30 -184.48 5.62 -9.37 -0.71 0
311688 126596874 1 O4N5C30H37 A4B5C30D37 -132.22 3.98 -8.78 -0.49 0
311689 126596875 1 N3O3C23H29 A3B3C23D29 -112.04 2.48 -9.1 -0.22 0
311690 126596876 1 SN2H20C30 AB2C20D30 130.73 1.39 -8.04 -0.65 0
311691 126596877 1 ClFO4N5H27C29 ABC4D5E27F29 -137.74 6.43 -9.34 -1.23 0
311692 126596880 1 O2N3H21C38 A2B3C21D38 225.89 5.52 -8.45 -1.52 0
311693 126596881 1 SN2H22C30 AB2C22D30 134.74 3.09 -8.03 -0.43 0
311694 126596884 1 ClF2N5O8C36H38 AB2C5D8E36F38 -375.34 6.61 -9.33 -0.98 0
311695 126596885 1 NSH35C40 ABC35D40 124.66 2.18 -7.78 -0.35 0
311696 126596886 1 O5N8H32C33 A5B8C32D33 -39.5 3.06 -8.82 -1.37 0
311697 126596888 1 O2N3H25C39 A2B3C25D39 219.9 3.19 -8.22 -1.93 0
311698 126596890 1 SN2H28C40 AB2C28D40 176.5 2.98 -8.31 -0.78 0
311700 126596892 1 ClF2N4O4H25C30 AB2C4D4E25F30 -173.78 5.12 -9.3 -1.14 0
311702 126596894 1 FO5N6H31C34 AB5C6D31E34 -111.0 7.14 -8.91 -2.05 0