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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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34900 7979068 1 OS2N4C19H20 AB2C4D19E20 54.53 7.22 -9.02 -0.84 0
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34901 7979069 1 SN2O4C18H22 AB2C4D18E22 -159.0 3.38 -9.26 -0.38 0
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34902 7979070 1 SO2N3C18H21 AB2C3D18E21 -8.37 7.26 -8.46 -0.3 0
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34903 7979071 1 SN2O4C21H26 AB2C4D21E26 -156.17 5.03 -9.09 -0.25 0
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34904 7979072 1 ClN4O5H13C16 AB4C5D13E16 -63.19 6.55 -9.84 -1.83 0
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34905 7979073 1 ClN3O4C20H20 AB3C4D20E20 -106.37 7.29 -8.44 -0.94 0
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34906 7979074 1 ClN3O4C20H20 AB3C4D20E20 -106.47 5.94 -8.49 -1.0 0
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34907 7979075 1 SN2O4C21H26 AB2C4D21E26 -157.25 2.35 -9.06 -0.25 0
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34908 7979076 1 ClN2O4C19H19 AB2C4D19E19 -86.74 5.34 -8.74 -0.73 0
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34909 7979077 1 SN2O4C22H28 AB2C4D22E28 -174.0 4.58 -9.31 -0.45 0
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34910 7979078 1 SN2O4C22H28 AB2C4D22E28 -171.48 4.02 -9.31 -0.43 0
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34911 7979079 1 SN2O4C22H28 AB2C4D22E28 -168.45 4.32 -9.09 -0.21 0
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34912 7979080 1 ClO3N4C20H21 AB3C4D20E21 -70.06 3.15 -8.69 -0.89 0
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34913 7979081 1 SN2O4C21H28 AB2C4D21E28 -169.37 4.61 -9.09 -0.23 0
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34914 7979082 1 ClSN2O2C15H15 ABC2D2E15F15 -30.98 2.39 -9.15 -0.86 0
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34915 7979083 1 SN2O4C21H28 AB2C4D21E28 -167.04 1.67 -9.02 -0.21 0
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34916 7979084 1 BrClFN2O2H11C16 ABCD2E2F11G16 -48.38 2.52 -9.68 -1.31 0
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34917 7979085 1 ClF2N3O4H14C17 AB2C3D4E14F17 -207.51 3.8 -9.9 -1.0 0
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34918 7979086 1 SN2O4C21H28 AB2C4D21E28 -168.86 4.33 -8.98 -0.16 0
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34919 7979087 2 NSO2C10H10 ABC2D10E10 -111.32 5.2 -9.27 -0.48 0
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34920 7979088 1 ClSN2O3C17H17 ABC2D3E17F17 -80.97 3.32 -9.44 -0.8 0
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34921 7979089 1 SN2O5C16H22 AB2C5D16E22 -191.12 6.85 -9.07 -0.66 0
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34922 7979090 1 SN2O5C16H22 AB2C5D16E22 -190.91 7.4 -9.06 -0.66 0
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34923 7979091 1 O3N4H22C23 A3B4C22D23 19.37 5.64 -8.76 -0.63 0
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34924 7979093 1 ClON2H13C14 ABC2D13E14 30.81 0.57 -8.56 -0.42 0
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34925 7979094 1 NO4H23C24 AB4C23D24 -100.97 5.7 -8.9 -0.23 0
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34926 7979095 1 NO6C19H19 AB6C19D19 -139.18 4.83 -9.52 -1.3 0
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34927 7979096 1 ClN2O4H15C19 AB2C4D15E19 -56.52 1.07 -9.12 -0.96 0
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34928 7979097 3 NOC7H9 ABC7D9 -98.42 1.8 -8.91 -0.7 0
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34929 7979098 1 SN3O5C16H17 AB3C5D16E17 -182.95 4.84 -9.02 -0.22 0
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34930 7979099 1 Cl2N2O4C19H20 A2B2C4D19E20 -116.88 6.33 -8.91 -0.89 0
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34931 7979100 1 ClN3O4C20H22 AB3C4D20E22 -120.37 3.25 -9.28 -0.65 0
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34932 7979101 1 SN3O5C16H17 AB3C5D16E17 -185.4 5.19 -9.06 -0.23 0
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34933 7979102 1 ClN2O3C10H11 AB2C3D10E11 -98.75 1.84 -9.95 -0.87 0
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34934 7979103 1 SN3O5C16H17 AB3C5D16E17 -186.26 4.67 -9.08 -0.22 0
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34935 7979104 1 ClO2N3H10C13 AB2C3D10E13 -4.1 3.29 -9.18 -1.09 0
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34936 7979107 1 SN3O5C17H19 AB3C5D17E19 -187.28 2.47 -9.16 -0.33 0
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34937 7979108 1 ClSN3O3C19H20 ABC3D3E19F20 -70.54 1.29 -8.83 -0.72 0
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34938 7979110 1 O2N3H19C21 A2B3C19D21 5.65 4.73 -8.4 -1.13 0
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34939 7979111 1 SCl2N2O2H16C17 AB2C2D2E16F17 -39.84 1.32 -8.81 -0.85 0
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34940 7979113 1 SN2O5C19H20 AB2C5D19E20 -184.33 4.3 -9.23 -0.4 0
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34941 7979114 1 SN2O5C19H20 AB2C5D19E20 -189.21 3.02 -9.09 -0.22 0
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34942 7979116 1 SN2O5C19H20 AB2C5D19E20 -187.84 4.05 -9.08 -0.24 0
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34943 7979117 1 BrClO2N3H9C13 ABC2D3E9F13 -0.01 2.5 -9.49 -1.42 0
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34944 7979119 1 NSO6C21H21 ABC6D21E21 -205.38 3.49 -9.19 -0.34 0
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34945 7979120 1 ClN2O2C17H23 AB2C2D17E23 -84.19 1.17 -9.71 -0.75 0
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34946 7979121 1 NSO6C21H21 ABC6D21E21 -203.59 4.06 -9.21 -0.4 0
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34947 7979122 1 ClN2O4H17C18 AB2C4D17E18 -88.83 7.67 -8.84 -0.68 0
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34948 7979123 1 NSO6C21H21 ABC6D21E21 -203.25 3.67 -9.21 -0.39 0
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34949 7979124 1 NSO6C21H21 ABC6D21E21 -205.35 2.99 -9.16 -0.36 0
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34950 7979125 1 SN2O6C18H20 AB2C6D18E20 -237.61 5.32 -9.11 -0.27 0
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34951 7979126 1 ClN2O4H11C17 AB2C4D11E17 -78.85 4.68 -9.28 -1.79 0
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34952 7979127 1 SN2O6C18H20 AB2C6D18E20 -233.64 1.34 -9.16 -0.33 0
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34953 7979128 1 ClSN3O3C19H20 ABC3D3E19F20 -75.47 4.38 -9.18 -1.08 0
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34954 7979129 1 ClN3O4H18C20 AB3C4D18E20 -51.04 2.27 -9.32 -0.78 -1
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34955 7979130 1 NO4H20C23 AB4C20D23 -41.56 4.04 0.0 0.0 0
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34956 7979131 1 FNSO4H20C21 ABCD4E20F21 -161.72 2.4 -9.08 -0.31 0
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34957 7979133 1 FNSO4H20C21 ABCD4E20F21 -159.53 5.24 -9.02 -0.36 0
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34958 7979135 1 FNSO4H20C21 ABCD4E20F21 -161.62 1.6 -9.05 -0.27 0
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34959 7979136 1 ClN3O4C20H20 AB3C4D20E20 -108.51 2.04 -8.27 -0.92 0
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34960 7979137 1 NSO6H19C20 ABC6D19E20 -182.99 3.97 -9.27 -0.83 0
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34961 7979138 1 O3N5H17C22 A3B5C17D22 20.22 3.03 -9.34 -1.09 0
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34962 7979139 1 NSO6H19C20 ABC6D19E20 -186.42 1.0 -9.2 -0.74 0
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34963 7979140 1 O3N4C24H26 A3B4C24D26 -47.15 3.04 -9.36 -1.08 0
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34964 7979141 1 SN2O3C22H24 AB2C3D22E24 -72.87 5.32 -8.95 -0.76 0
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34965 7979142 1 SN3O5C18H21 AB3C5D18E21 -195.94 5.48 -9.34 -0.52 0
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34966 7979143 1 N2O5C11H12 A2B5C11D12 -182.44 4.17 -9.13 -0.4 0
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34967 7979144 1 SN2O3C22H24 AB2C3D22E24 -75.39 7.41 -8.94 -0.87 0
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34968 7979146 1 SN3O5C18H21 AB3C5D18E21 -191.24 4.82 -9.29 -0.41 0
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34969 7979147 1 N4O5H16C17 A4B5C16D17 -63.56 4.18 -9.59 -1.6 0
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34970 7979148 1 N3O5C21H21 A3B5C21D21 -137.82 4.02 -8.34 -0.57 0
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34971 7979149 1 NO6C18H19 AB6C18D19 -193.79 5.11 -8.16 -0.85 0
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34972 7979151 1 SN2O4C22H22 AB2C4D22E22 -125.22 6.49 -8.7 -0.58 0
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34973 7979152 1 BrFN2O3H14C16 ABC2D3E14F16 -98.4 3.24 -9.46 -0.79 0
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34974 7979153 1 N2O4H14C17 A2B4C14D17 -83.08 6.68 -9.3 -1.2 0