List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
133011 51461559 1 S2O6N9C16H17 A2B6C9D16E17 -10.7 4.59 -9.69 -1.39 -1
133012 51461560 1 S2O6N9C16H16 A2B6C9D16E16 36.91 3.43 0.0 0.0 0
133013 51461561 1 S2O6N9C16H17 A2B6C9D16E17 -13.95 8.37 -9.43 -1.54 -1
133014 51461592 1 SN4O6C16H17 AB4C6D16E17 -144.27 2.32 0.0 0.0 0
133015 51461971 1 SCl2N2O4H18C20 AB2C2D4E18F20 -149.09 3.5 -9.19 -1.51 1
133016 51462977 1 SO2N6C25H39 AB2C6D25E39 -25.57 3.22 0.0 0.0 -1
133017 51463004 1 NO6H30C31 AB6C30D31 -104.6 5.29 0.0 0.0 -1
133018 51463005 1 N2O5H25C28 A2B5C25D28 -48.76 19.52 0.0 0.0 -1
133019 51463006 1 NCl2O4H22C28 AB2C4D22E28 -59.87 7.4 0.0 0.0 -1
133020 51463007 1 NCl2O4H22C28 AB2C4D22E28 -61.5 6.85 0.0 0.0 -1
133021 51463008 1 NO6C26H28 AB6C26D28 -156.73 6.35 0.0 0.0 -1
133022 51463009 1 NO7C27H30 AB7C27D30 -184.33 5.89 0.0 0.0 -1
133023 51463010 1 NO7H26C29 AB7C26D29 -144.49 5.79 0.0 0.0 0
133024 51463882 1 SO2N6C26H38 AB2C6D26E38 -65.01 6.57 -8.92 -0.61 1
133025 51464534 1 SN5O7C21H30 AB5C7D21E30 -214.1 7.41 0.0 0.0 0
133026 51464808 1 NCl2O4H13C18 AB2C4D13E18 -105.95 3.55 -9.25 -1.33 0
133027 51464860 1 SO2F4N4H20C22 AB2C4D4E20F22 -178.48 11.33 -9.04 -1.02 0
133028 51464983 1 N3O4C31H31 A3B4C31D31 -72.81 7.91 -8.52 -0.5 0
133029 51465050 1 SN3O5C19H25 AB3C5D19E25 -173.17 6.29 -9.47 -1.24 0
133030 51465051 1 SN4O6C20H20 AB4C6D20E20 -169.19 12.06 -9.8 -1.0 0
133031 51465052 1 SN4O6C20H20 AB4C6D20E20 -168.75 10.65 -10.03 -1.36 0
133032 51465175 1 OF3N4C26H27 AB3C4D26E27 -123.9 5.47 -9.23 -1.6 0
133033 51465729 1 NO6H29C32 AB6C29D32 -162.85 10.0 -9.15 -0.66 0
133034 51465887 1 OS2N5C29H29 AB2C5D29E29 96.47 7.48 -8.4 -1.1 0
133035 51465888 1 OS2N5C29H29 AB2C5D29E29 95.54 5.25 -8.42 -1.16 0
133036 51465910 1 SN2O4C30H30 AB2C4D30E30 -85.6 8.08 -8.28 -0.54 0
133037 51465970 1 BrSO2N5C20H20 ABC2D5E20F20 36.76 7.34 -9.0 -1.29 1
133038 51466488 1 SO2N3C19H22 AB2C3D19E22 -39.4 4.28 0.0 0.0 0
133039 51466899 1 ClNO2C12H14 ABC2D12E14 -60.32 6.15 -8.58 -0.21 0
133040 51467367 1 BrO2N3H20C25 AB2C3D20E25 50.87 6.04 -8.78 -0.82 -1
133041 51467384 1 N3O5H20C26 A3B5C20D26 -8.2 18.08 0.0 0.0 -1
133042 51467915 1 SCl2O3N4H17C20 AB2C3D4E17F20 17.74 2.32 0.0 0.0 1
133043 51467994 1 OSF3N5H19C24 ABC3D5E19F24 -57.79 7.85 0.0 0.0 1
133044 51467995 1 OSN5H26C30 ABC5D26E30 117.17 8.55 0.0 0.0 1
133045 51467996 1 Cl2F3N3O3H13C16 A2B3C3D3E13F16 -175.78 5.99 0.0 0.0 0
133046 51468029 1 N2O2C13H18 A2B2C13D18 -82.88 3.17 -8.67 0.31 1
133047 51468032 1 SO4N7C23H26 AB4C7D23E26 -81.81 3.83 0.0 0.0 0
133048 51468047 1 SN3O3H23C24 AB3C3D23E24 -17.84 3.92 -8.18 -1.05 1
133049 51468048 1 SN3O3C24H24 AB3C3D24E24 -6.9 15.21 0.0 0.0 0
133050 51468108 1 O2N4C23H24 A2B4C23D24 -9.69 3.54 -8.96 -0.32 0
133051 51468178 1 ClO3N5H14C17 AB3C5D14E17 -3.23 6.29 -9.01 -1.8 0
133052 51468188 1 SN3O4C22H27 AB3C4D22E27 -130.36 5.47 -9.06 -0.53 0
133053 51468229 1 Cl2O3N5H17C20 A2B3C5D17E20 -36.21 5.3 -9.26 -1.01 0
133054 51468348 1 ClOSN4H17C22 ABCD4E17F22 75.7 2.41 -8.94 -1.5 0
133055 51468587 1 O4N6C21H22 A4B6C21D22 -27.32 2.64 -9.18 -0.78 0
133056 51468611 1 ClNO5C25H26 ABC5D25E26 -166.31 8.07 -8.78 -0.64 0
133057 51469166 1 NSO5C26H27 ABC5D26E27 -155.07 5.81 -8.45 -0.52 -1
133058 51470380 1 SO2N4C21H23 AB2C4D21E23 19.26 3.77 0.0 0.0 0
133059 51470420 2 NO3C10H15 AB3C10D15 -269.0 5.72 -8.84 -0.89 0
133060 51470726 1 SO2N5C27H43 AB2C5D27E43 -104.04 6.02 -8.62 -0.36 0
133061 51470936 1 SO2N5C27H41 AB2C5D27E41 -89.47 3.58 -8.51 -0.18 1
133062 51471353 1 O2N7H22C23 A2B7C22D23 85.54 8.58 0.0 0.0 0
133063 51471484 1 O2S2N3C22H25 A2B2C3D22E25 -29.19 3.27 -9.05 -0.32 0
133064 51471485 1 O2S2N3C22H25 A2B2C3D22E25 -28.45 7.39 -9.05 -0.58 -1
133065 51471665 1 O3N4H7C10 A3B4C7D10 16.12 2.52 0.0 0.0 -1
133066 51471666 1 BrSO2N5H9C13 ABC2D5E9F13 45.64 8.02 0.0 0.0 -1
133067 51471667 1 SO3N5H12C14 AB3C5D12E14 5.88 7.57 0.0 0.0 0
133068 51471786 1 FSO3N5C18H22 ABC3D5E18F22 -54.93 12.49 -9.27 -1.27 0
133069 51472854 1 SO2N5C24H39 AB2C5D24E39 -98.41 3.97 -9.06 -0.67 0
133070 51473102 1 FOS2N4C18H23 ABC2D4E18F23 -27.17 3.67 -8.55 -1.12 1
133071 51473103 1 SN4O5C27H31 AB4C5D27E31 -33.85 13.28 0.0 0.0 1
133072 51473280 1 ClSN2O3C17H22 ABC2D3E17F22 -56.28 5.98 0.0 0.0 0
133073 51473715 1 N4O5H16C22 A4B5C16D22 -95.79 5.48 -9.29 -1.55 -1
133074 51474082 1 SN3O4C13H14 AB3C4D13E14 -97.88 9.21 0.0 0.0 0
133075 51474325 1 N3S3O4C18H23 A3B3C4D18E23 -110.04 4.86 -9.11 -1.18 0
133076 51474326 1 S2O3N4H20C22 A2B3C4D20E22 16.15 5.71 -8.67 -1.01 0
133077 51474327 1 ClSN3O3H14C15 ABC3D3E14F15 -67.29 3.08 -9.23 -1.0 0
133078 51474328 1 ClSN3O3H14C15 ABC3D3E14F15 -64.02 3.36 -9.02 -0.73 0
133079 51474329 1 Cl2N3O4H11C15 A2B3C4D11E15 -88.66 4.68 -9.85 -1.88 0
133080 51474330 1 SCl2N3O3H21C22 AB2C3D3E21F22 -76.64 7.45 -8.86 -0.44 0
133081 51474331 1 SCl2N3O3H21C22 AB2C3D3E21F22 -77.92 6.21 -8.97 -0.51 0
133082 51474559 1 N2O4H18C23 A2B4C18D23 -16.12 6.55 -8.76 -1.18 0
133083 51474859 1 SO2N4C21H30 AB2C4D21E30 -41.29 3.01 -8.91 -0.28 0
133084 51474860 1 SF3O3N4C21H21 AB3C3D4E21F21 -198.33 9.34 -9.09 -0.84 0
133085 51474861 1 SF3O3N4C21H21 AB3C3D4E21F21 -196.16 10.87 -9.12 -0.72 0
133086 51474862 1 NSO6H23C24 ABC6D23E24 -183.67 6.69 -8.92 -1.18 0
133087 51474863 1 NSO6H23C24 ABC6D23E24 -181.4 3.42 -8.88 -0.93 0
133088 51474864 1 SN2O7C18H18 AB2C7D18E18 -177.76 8.25 -9.78 -1.54 0
133089 51474865 1 SN2O7C18H18 AB2C7D18E18 -179.52 8.91 -9.67 -1.46 0
133090 51474866 1 ClNSO5H22C24 ABCD5E22F24 -159.19 4.18 -8.93 -0.97 0
133091 51474920 1 SO4N5C24H25 AB4C5D24E25 -74.17 9.91 -8.7 -0.76 0
133092 51474921 1 SO3N5H25C26 AB3C5D25E26 -7.44 5.99 -8.56 -0.92 0
133093 51474922 1 SO3N5H25C26 AB3C5D25E26 -8.53 5.98 -8.44 -0.88 0
133094 51474923 1 SO3N5C19H19 AB3C5D19E19 31.31 11.49 -9.24 -1.11 1
133095 51476795 1 O2N7C19H30 A2B7C19D30 -20.1 15.18 0.0 0.0 0
133096 51476828 1 SN3O6C20H21 AB3C6D20E21 -183.52 2.96 -8.76 -1.14 1
133097 51477242 1 NO2C13H28 AB2C13D28 -111.82 3.15 0.0 0.0 0
133098 51477392 1 N3O4C22H27 A3B4C22D27 -167.21 2.73 -8.75 -0.01 0
133099 51477393 1 NOSC18H21 ABCD18E21 -16.61 3.96 -8.97 -0.21 0
133100 51477394 1 SN3O3C26H27 AB3C3D26E27 -63.3 6.1 -9.22 -0.34 0
133101 51477395 1 SN3O3C26H27 AB3C3D26E27 -60.5 2.49 -9.22 -0.37 0
133102 51477396 1 SN3O3C26H27 AB3C3D26E27 -61.49 6.75 -9.08 -0.35 0
133103 51477397 1 SN3O3C26H27 AB3C3D26E27 -59.78 1.72 -9.09 -0.28 0
133104 51477398 1 NOSC18H21 ABCD18E21 -19.15 2.43 -8.85 -0.08 0
133105 51477652 1 ClFSN2O4H18C19 ABCD2E4F18G19 -186.48 6.29 -9.01 -0.93 0
133106 51477700 1 O4N5C27H33 A4B5C27D33 -133.78 6.9 -9.0 -0.86 0
133107 51477773 1 O2S2N3C19H25 A2B2C3D19E25 -48.22 5.68 -8.84 -1.04 0
133108 51477774 1 S2O3N4C14H16 A2B3C4D14E16 -77.89 3.12 -9.11 -1.27 0
133109 51477859 1 SF2N2O2C16H18 AB2C2D2E16F18 -120.64 5.14 -9.06 -0.89 1
133110 51477860 1 SF2N2O2C16H19 AB2C2D2E16F19 -112.48 3.3 0.0 0.0 0