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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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384860 134977814 1 ClN2C7H14 AB2C7D14 51.46 0.56 0.0 0.0 0
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384861 134977815 1 SbN3Cl6C9H20 AB3C6D9E20 -116.7 16.36 -9.03 -1.72 0
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384862 134977816 1 O2H14C17 A2B14C17 21.9 2.98 -9.41 -1.04 0
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384863 134977817 1 SiO4C19H36 AB4C19D36 -225.28 3.2 -8.9 -0.29 0
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384864 134977818 1 OC15H26 AB15C26 -60.61 3.51 -9.66 0.22 0
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384865 134977819 1 NO2C27H33 AB2C27D33 -16.65 4.91 -8.42 -0.05 0
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384866 134977824 1 OPC15H25 ABC15D25 -74.0 2.48 -8.72 0.18 0
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384867 134977825 1 NPSO3C14H22 ABCD3E14F22 -142.36 4.04 -8.94 -0.15 1
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384868 134977826 1 NPSO3C14H23 ABCD3E14F23 -137.35 6.67 0.0 0.0 0
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384869 134977827 1 ClPO2C22H22 ABC2D22E22 -39.99 5.72 -9.21 -0.27 0
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384870 134977828 1 ClNOPC21H21 ABCDE21F21 -4.47 7.37 -9.18 -0.17 0
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384871 134977829 1 ClNOPH31C34 ABCDE31F34 44.88 5.97 -9.24 -0.23 0
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384872 134977830 1 BrNPO2C29H29 ABCD2E29F29 -10.11 6.04 -8.78 -0.18 0
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384873 134977832 1 BrOPC24H28 ABCD24E28 -4.56 6.59 -8.56 -0.11 0
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384874 134977833 1 BrNOPC27H31 ABCDE27F31 -13.2 5.48 -8.72 -0.23 0
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384875 134977834 1 BrNPO3C34H69 ABCD3E34F69 -311.04 13.35 -7.45 -0.59 0
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384877 134977836 1 NPS2Cl3O4F6H19C23 ABC2D3E4F6G19H23 -447.27 18.94 -10.2 -1.31 0
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384878 134977839 1 OSiC19H28 ABC19D28 -38.75 3.77 -8.62 0.16 0
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384879 134977842 1 PSSiF3O4C23H26 ABCD3E4F23G26 -326.87 10.31 -9.87 -0.51 0
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384880 134977844 1 P2Si2C11H30 A2B2C11D30 -336.26 7.47 -7.49 0.36 0
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384881 134977854 4 OC5H5 AB5C5 96.64 10.4 -8.24 -0.81 0
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384882 134977859 1 Si2O11C34H56 A2B11C34D56 -525.41 3.93 -8.72 -0.65 0
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384883 134977863 1 PSN7O11C24H32 ABC7D11E24F32 -498.96 10.0 -9.34 -1.07 0
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384884 134977864 1 NPO5C15H34 ABC5D15E34 -307.91 13.17 -9.52 -0.14 -2
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384885 134977866 1 N2P2C16O17H24 A2B2C16D17E24 -718.95 3.08 -10.45 -2.36 -2
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384886 134977867 1 P2N10O15C20H24 A2B10C15D20E24 -528.36 15.78 -8.98 -2.12 -2
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384887 134977868 1 P2N6O15C18H24 A2B6C15D18E24 -660.18 9.91 -9.24 -2.47 0
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384888 134977871 1 PSSiN5O12C54H64 ABCD5E12F54G64 -515.35 4.33 -8.76 -1.08 0
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384889 134977872 1 PSSiN7O11C52H68 ABCD7E11F52G68 -477.02 16.0 -8.6 -0.41 0
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384890 134977873 1 PSSiN5O12C54H64 ABCD5E12F54G64 -514.9 10.48 -8.95 -0.92 0
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384891 134977875 1 PSSiN8O11C61H67 ABCD8E11F61G67 -370.95 13.0 -8.68 -1.05 0
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384892 134977885 1 PSSiN4O14C50H65 ABCD4E14F50G65 -637.22 6.96 -8.9 -0.51 0
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384893 134977887 1 PSSiN7O13C57H68 ABCD7E13F57G68 -484.21 6.7 -8.86 -1.0 0
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384894 134977888 1 PSSiN7O13C54H72 ABCD7E13F54G72 -535.18 11.91 -8.69 -0.47 0
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384895 134977889 1 PSSiN5O14C56H68 ABCD5E14F56G68 -567.26 9.5 -8.78 -0.87 0
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384896 134977891 1 PSSiN8O13C63H71 ABCD8E13F63G71 -433.12 10.05 -8.78 -0.96 -1
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384897 134977893 1 PF3N5O8C12H12 AB3C5D8E12F12 -429.18 15.08 0.0 0.0 -2
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384898 134977896 1 P2N5C10O10H13 A2B5C10D10E13 -374.75 4.68 -9.26 -1.62 -2
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384899 134977898 1 P2N3C9O11H13 A2B3C9D11E13 -467.5 5.74 -9.94 -1.94 0
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384900 134977900 1 P3N5C12O13H18 A3B5C12D13E18 -701.27 9.79 -9.29 -0.71 -3
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384901 134977901 1 P3N4C8H12O13 A3B4C8D12E13 -535.64 8.84 0.0 0.0 0
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384902 134977904 1 SC11H12 AB11C12 54.29 1.74 -8.62 -0.18 0
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384903 134977905 1 SC20H22 AB20C22 61.87 0.91 -8.54 -0.1 0
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384904 134977906 1 NO2H15C22 AB2C15D22 139.95 7.55 -8.93 -1.74 0
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384906 134977914 1 OC27H44 AB27C44 -88.32 3.28 -8.77 0.48 0
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384908 134977917 1 CoC21H29 AB21C29 42.01 4.83 -11.4 -5.16 0
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384910 134977926 1 NCo2O9H13C24 AB2C9D13E24 -220.33 35.86 -9.61 -5.99 0
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384911 134977927 1 NO3H13C18 AB3C13D18 49.58 4.63 -9.1 -0.5 0
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384912 134977930 2 CoO4H5C9 AB4C5D9 -128.62 31.09 -9.55 -5.3 0
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384913 134977932 1 SSiCo2O9H30C31 ABC2D9E30F31 -273.74 24.51 -8.84 -6.99 0
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384914 134977940 26 CH AB 85.15 1.27 -8.52 -0.38 0
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384915 134977941 2 C11H17 A11B17 -18.29 0.89 -8.7 0.19 0
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384916 134977942 1 LiC8H13 AB8C13 3.35 6.37 -6.48 2.6 0
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384917 134977946 1 NO3C20H26 AB3C20D26 -53.0 8.68 0.0 0.0 0
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384918 134977955 1 PC12H25 AB12C25 -63.38 1.48 -8.52 3.3 0
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384919 134977957 1 BC11H23 AB11C23 -58.95 0.1 -9.5 0.52 0
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384920 134977964 1 NSO4H23C29 ABC4D23E29 -42.31 8.91 -8.24 -0.68 0
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384921 134977965 1 NSO4H21C28 ABC4D21E28 -30.96 6.14 -8.22 -0.86 0
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384922 134977967 1 BrO2H11C16 AB2C11D16 35.96 3.52 -9.77 -1.3 0
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384923 134977970 2 H14C17 A14B17 197.42 0.87 -8.03 -0.1 0
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384924 134977971 6 C5H6 A5B6 70.82 1.57 -8.06 -0.05 0
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384925 134977974 1 N2O4H24C31 A2B4C24D31 13.74 1.85 -8.5 -1.43 0
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384926 134977975 1 BH2C3F7 AB2C3D7 -435.96 2.26 -12.07 0.84 0
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384927 134977977 1 BH2C3Br7 AB2C3D7 9.57 11.15 -9.74 -3.87 0
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384928 134977978 1 BNF4H20C22 ABC4D20E22 -260.74 13.91 -9.89 -2.02 1
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384929 134977979 1 NH20C22 AB20C22 108.43 1.17 0.0 0.0 0
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384930 134977980 1 BNOF4H20C22 ABCD4E20F22 -221.48 19.45 -8.75 -3.12 0
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384931 134977983 1 O2H14C17 A2B14C17 23.17 4.54 -9.38 -1.04 0
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384932 134977984 1 C11H14 A11B14 60.7 1.93 -8.6 0.15 0
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384933 134977988 1 PO2C18H27 AB2C18D27 -124.73 6.29 -8.18 0.42 1
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384934 134977989 1 PO2C18H28 AB2C18D28 -99.45 9.25 0.0 0.0 1
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384935 134977991 1 PO2C20H32 AB2C20D32 -109.41 9.36 0.0 0.0 0
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384936 134977992 1 PO2C22H27 AB2C22D27 -77.7 7.23 -7.98 -0.63 1
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384937 134977993 1 PO2C22H28 AB2C22D28 -61.84 9.25 0.0 0.0 0
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384940 134978001 1 CrPO3C14H17 ABC3D14E17 68.31 3.65 -7.61 0.05 0
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384941 134978002 1 PO3C19H19 AB3C19D19 -93.83 3.74 -9.22 0.06 0
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384942 134978003 1 ClPSeO4H28C29 ABCD4E28F29 77.31 11.75 -9.0 -2.33 0
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384943 134978004 1 BrPSO3C29H30 ABCD3E29F30 -40.78 6.6 -8.43 -0.24 0
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384944 134978005 1 BrPSH26C27 ABCD26E27 76.5 5.47 -8.52 -0.18 0
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384945 134978006 1 IPSC22H24 ABCD22E24 42.87 7.29 -7.87 -0.3 0
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384946 134978008 1 PS2O6C28H29 AB2C6D28E29 -191.27 9.79 -9.59 -0.39 0
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384947 134978011 1 BrNPO2C24H27 ABCD2E24F27 -42.35 6.55 -8.83 -0.11 0
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384948 134978014 1 NSSiO4C25H35 ABCD4E25F35 -173.45 4.58 -8.79 -0.44 0
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384949 134978018 1 ClNSO5C28H28 ABCD5E28F28 -138.08 8.15 -8.48 -0.62 0
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384950 134978020 1 PSSiF3O4C20H44 ABCD3E4F20G44 -490.52 11.09 -10.24 0.55 0
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384951 134978021 1 BrPO2C22H22 ABC2D22E22 -41.37 3.32 -8.74 -0.23 0
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384952 134978022 1 NSO5C22H25 ABC5D22E25 -157.33 5.4 -8.86 -0.36 0
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384953 134978023 1 O2C9H12 A2B9C12 -64.92 3.0 -10.0 -0.17 0
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384954 134978026 1 PSF3O3H30C31 ABC3D3E30F31 -202.11 11.39 -9.59 -0.52 0
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384955 134978027 1 OF2C14H14 AB2C14D14 -126.32 3.95 -9.39 -0.52 0
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384956 134978028 1 O3C9H10 A3B9C10 -88.27 1.32 -9.44 -0.76 0
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384957 134978033 1 PC18H37 AB18C37 -94.63 1.35 -8.06 3.37 0
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384958 134978034 1 PSSiN2O2C19H43 ABCD2E2F19G43 -233.15 1.23 -7.66 0.32 0
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384959 134978035 2 SiC11H15 AB11C15 152.56 0.11 -9.06 -0.68 0
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384961 134978038 1 OSiC19H22 ABC19D22 68.58 1.74 -8.72 -0.8 0
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384962 134978039 2 H5C6 A5B6 161.67 0.01 -9.16 -0.35 0
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384963 134978041 1 BrNOC16H18 ABCD16E18 -1.38 2.36 -9.5 -0.62 0
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384964 134978043 2 C7H11 A7B11 24.04 0.08 -9.42 0.85 0
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384965 134978045 1 PSeN6O9C18H25 ABC6D9E18F25 -351.22 9.59 -9.57 -0.67 0
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384966 134978046 1 P4Se4O18C33H72 A4B4C18D33E72 -925.11 6.72 -9.22 -0.53 -1