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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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11839 121747 1 NaSN3O7H12C20 ABC3D7E12F20 -149.15 11.47 -9.53 -2.51 0
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11840 121758 1 NO2S2C7H15 AB2C2D7E15 -112.66 7.64 -9.13 -1.12 0
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11841 121761 1 ClNOC15H20 ABCD15E20 -40.42 3.58 -8.3 0.1 0
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11842 121824 1 TiF4 AB4 -362.73 0.02 -14.58 -2.79 0
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11843 121832 1 O3C20H32 A3B20C32 -134.84 3.39 -8.52 -0.27 0
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11844 121883 1 SN2O4C14H18 AB2C4D14E18 -127.26 7.1 -8.92 -0.56 0
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11845 121905 1 N3O6C20H21 A3B6C20D21 -194.02 4.82 -9.48 -1.04 0
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11846 121925 1 N5C11H13 A5B11C13 89.99 5.3 -8.18 -0.26 0
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11847 121980 1 N2O3S3C16H20 A2B3C3D16E20 -78.55 5.43 -8.52 -0.99 0
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11848 121986 1 AlO9H16C18 AB9C16D18 -187.31 6.68 0.0 0.0 1
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11849 121987 1 S2N6O9C35H38 A2B6C9D35E38 -247.56 4.0 -9.74 -0.75 0
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11850 121990 1 SP2N5O10C11H17 AB2C5D10E11F17 -502.47 3.15 -8.74 -0.71 0
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11851 121997 1 FN2O2C4H5 AB2C2D4E5 -131.84 3.84 -10.74 -0.34 0
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11852 122002 1 PN8O10C19H25 AB8C10D19E25 -415.34 13.42 -9.13 -0.72 0
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11853 122007 1 O4C21H34 A4B21C34 -196.38 6.0 -9.49 0.52 0
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11854 122027 1 N3O4C16H19 A3B4C16D19 -76.18 4.55 -9.43 -1.54 0
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11855 122032 1 ClN2O8C35H43 AB2C8D35E43 -297.95 6.59 -8.63 -0.12 0
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11856 122045 1 C5O6H10 A5B6C10 -271.34 4.56 -10.93 0.08 0
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11857 122058 1 SN2O4C5H8 AB2C4D5E8 -119.4 5.57 -9.66 -1.54 0
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11858 122060 1 FN2P3C9H14O15 AB2C3D9E14F15 -881.69 7.76 -10.14 -0.93 0
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11859 122068 1 ClON3C18H18 ABC3D18E18 11.97 7.74 -8.54 -0.7 0
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11860 122075 1 N4O6C37H48 A4B6C37D48 -203.21 11.67 -8.89 -1.44 0
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11861 122076 1 O2N4C33H44 A2B4C33D44 -35.26 8.95 -8.37 -0.33 0
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11862 122077 1 ClSN3O3H14C20 ABC3D3E14F20 -22.99 5.06 -9.14 -1.27 0
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11863 122078 1 NPO6C11H20 ABC6D11E20 -347.88 7.36 -9.75 0.49 0
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11864 122079 1 N3O7C16H17 A3B7C16D17 -262.72 7.49 -8.96 -1.36 0
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11865 122080 1 O6N7C44H57 A6B7C44D57 -227.38 10.67 -8.71 -0.22 0
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11866 122081 1 N2O9C41H48 A2B9C41D48 -247.23 2.84 -8.14 -0.07 0
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11867 122082 1 OH18C20 AB18C20 24.75 1.63 -8.89 -0.25 0
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11868 122083 1 O2N3C10H23 A2B3C10D23 -110.62 5.23 -9.07 0.77 0
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11869 122107 1 N3O4C9H13 A3B4C9D13 -166.52 5.96 -10.1 -0.69 0
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11870 122154 1 N4O4H9C11 A4B4C9D11 -31.04 3.66 0.0 0.0 1
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11871 122162 1 ON2C19H20 AB2C19D20 -2.27 5.4 -8.24 0.07 0
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11872 122165 1 N3O6C18H29 A3B6C18D29 -254.43 7.04 -10.0 -0.39 0
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11873 122166 1 O5C28H48 A5B28C48 -298.88 5.54 -10.1 0.55 0
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11874 122311 1 NO4H9C10 AB4C9D10 -124.65 6.35 -8.83 -0.99 0
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11875 122318 1 N5O7C30H37 A5B7C30D37 -267.75 3.74 -8.89 -0.04 0
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11876 122375 1 ClO2H7C8 AB2C7D8 -69.52 3.23 -9.68 -0.89 0
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11877 122379 1 SO5C12H24 AB5C12D24 -260.71 1.51 -10.95 -0.28 0
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11878 122420 1 NO4C10H13 AB4C10D13 -160.92 7.44 -9.15 -0.64 0
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11879 122570 1 O4C9H10 A4B9C10 -124.56 5.42 -8.89 -0.61 0
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11880 122576 1 NSC7H11 ABC7D11 8.61 0.69 -9.11 -0.23 0
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11881 122577 1 OS2N8H10C15 AB2C8D10E15 203.4 5.34 -10.1 -2.15 0
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11882 122581 1 O5H10C14 A5B10C14 -150.04 1.07 -9.79 -0.93 0
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11883 122584 2 NC6H10 AB6C10 -13.02 0.16 -8.88 0.25 0
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11884 122585 1 ZrTe2 AB2 -589.41 3.9 -7.74 -2.75 0
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11885 122586 1 SN3O4C10H11 AB3C4D10E11 -68.72 7.65 -9.18 -0.51 0
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11886 122588 1 NOC9H11 ABC9D11 -9.84 3.2 -8.71 0.3 0
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11887 122591 1 BrNO3C22H30 ABC3D22E30 -96.15 14.44 -7.68 -0.67 0
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11888 122596 1 ClPO2S3C10H14 ABC2D3E10F14 -148.04 1.98 -9.09 -0.84 0
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11889 122598 1 OC25H44 AB25C44 -120.18 1.53 -8.72 0.36 0
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11890 122733 1 O4C9H10 A4B9C10 -120.01 2.11 -10.24 -0.97 0
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11891 122735 2 O2C7H11 A2B7C11 -174.9 5.7 -9.48 -0.2 0
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11892 122756 1 INC13H22 ABC13D22 12.95 14.64 -7.01 -0.94 0
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11893 122758 1 BrNH14C17 ABC14D17 70.56 0.85 -8.5 -0.59 0
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11894 122788 1 NPO4C34H65 ABC4D34E65 -319.74 3.66 0.0 0.0 1
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11895 122890 2 NO3H10C16 AB3C10D16 -120.75 2.23 -9.44 -1.73 0
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11896 122995 1 BrNSO4C9H18 ABCD4E9F18 -172.56 2.5 -9.37 -0.66 0
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11897 122996 1 SN2O4C7H7 AB2C4D7E7 -63.72 3.13 0.0 0.0 -1
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11898 122999 1 O2N6H8C11 A2B6C8D11 141.04 1.8 -9.83 -2.82 0
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11899 123016 1 H12C17 A12B17 73.01 0.92 -8.45 -0.55 0
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11901 123034 4 H4C7 A4B7 132.38 0.13 -7.72 -1.65 0
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11902 123064 1 FNOH4C7 ABCD4E7 -41.66 2.35 -9.94 -0.84 0
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11903 123094 1 S3H4C7 A3B4C7 67.14 3.7 -8.68 -1.46 0
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11904 123103 5 CH AB 56.41 0.06 0.0 0.0 -5
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11905 123119 1 NOSC2H7 ABCD2E7 -24.52 3.95 -9.23 1.28 0
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11906 123120 1 SnC7H18 AB7C18 -19.58 0.11 -9.64 1.22 0
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11907 123126 1 OC12H18 AB12C18 -74.18 3.4 -9.68 0.76 0
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11908 123145 1 C3H7 A3B7 11.24 0.4 0.0 0.0 0
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11909 123148 2 NC4H9 AB4C9 2.48 0.18 -8.91 0.59 0
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11910 123156 1 OC7H16 AB7C16 -86.63 2.06 -10.36 2.97 0
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11911 123161 1 SnH4 AB4 42.87 0.0 -11.31 2.28 0
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11912 123167 1 C5H11 A5B11 1.11 0.43 0.0 0.0 0
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11913 123169 1 CPH3Cl4 ABC3D4 -86.4 3.8 -11.06 -1.64 0
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11914 123170 1 BrC8H9 AB8C9 11.33 2.27 -9.51 -0.05 0
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11915 123173 1 C3H4 A3B4 60.92 0.18 -10.08 0.86 0
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11916 123183 2 NOC2H5 ABC2D5 -23.44 5.17 -10.73 -0.35 0
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11917 123313 1 BrH AB -15.73 1.16 -11.14 1.3 0
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11918 123317 1 OPN3H6 ABC3D6 -95.93 2.98 -10.27 1.35 0
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11919 123326 18 CH AB 47.21 0.95 -8.11 -0.85 0
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11920 123327 1 OsF6 AB6 -273.88 1.12 -8.93 -2.09 0
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11921 123330 1 ClSF5 ABC5 -255.32 0.56 -12.28 -2.67 0
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11922 123363 1 NC9H19 AB9C19 -25.56 1.48 -8.55 2.94 0
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11923 123420 2 O2C19H37 A2B19C37 -344.25 1.92 -10.54 0.87 0
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11924 123442 1 N3C10H11 A3B10C11 52.83 2.86 -8.56 0.0 0
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11925 123525 1 OC6H12 AB6C12 -50.14 2.23 -10.24 1.08 0
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11926 123605 1 NO7C26H37 AB7C26D37 -295.09 3.16 -8.34 -0.7 0
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11927 123606 1 SO2N3C17H25 AB2C3D17E25 -55.98 4.04 -8.35 0.02 0
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11929 123771 1 P2N5O10C12H15 A2B5C10D12E15 -467.35 1.47 -9.32 -1.28 0
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11930 123891 1 S2N5O5C14H15 A2B5C5D14E15 -86.26 8.43 -9.18 -0.85 0
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11931 123893 1 N2C23H36 A2B23C36 -14.07 2.93 -8.65 0.34 0
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11932 123896 1 HP3Ca4O12 AB3C4D12 -996.84 2.9 -9.22 -1.11 0
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11933 124004 2 N2O3C11H11 A2B3C11D11 -164.46 2.44 -9.29 -2.35 0
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11934 124030 1 NO19C41H47 AB19C41D47 -764.69 8.15 -10.18 -0.94 0
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11935 124038 1 O24C57H98 A24B57C98 -1200.72 5.82 -10.18 -0.33 0
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11936 124064 1 O6H10C15 A6B10C15 -165.54 12.92 -8.96 -1.54 0
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11937 124070 1 FN4O4C15H15 AB4C4D15E15 -167.69 9.77 -9.69 -1.6 0
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11938 124086 3 NO4C15H21 AB4C15D21 -485.95 3.83 -8.49 -1.56 0
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11939 124097 1 O4N7C9H15 A4B7C9D15 -126.9 4.21 -9.37 -1.61 0
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11940 124126 1 SN5O5C15H21 AB5C5D15E21 -170.34 4.28 -8.5 -0.22 0