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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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412059 135084922 2 NCl2O2C14H17 AB2C2D14E17 -165.17 8.87 -8.32 -1.26 0
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412060 135084923 1 CoO2N4H46C61 AB2C4D46E61 127.53 40.73 0.0 0.0 0
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412061 135084924 1 O2N4H46C61 A2B4C46D61 293.18 6.45 -7.49 -1.67 0
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412062 135084925 1 CoBr2N2O4C30H40 AB2C2D4E30F40 -188.26 33.12 0.0 0.0 0
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412063 135084926 1 CoN2O4C30H42 AB2C4D30E42 -228.72 14.81 0.0 0.0 0
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412064 135084927 1 CoN2O5C38H60 AB2C5D38E60 -357.04 30.05 0.0 0.0 -1
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412065 135084928 1 CoSN2F3O5C37H54 ABC2D3E5F37G54 -408.82 16.65 -8.83 -5.6 0
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412066 135084929 1 NiPO7C52H79 ABC7D52E79 -267.49 10.27 -7.76 -3.86 1
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412067 135084930 1 N2C42H47 A2B42C47 109.49 1.55 0.0 0.0 0
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412068 135084931 2 ON2C24H27 AB2C24D27 38.41 4.92 -8.48 -0.37 0
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412070 135084933 1 CrN2O4C30H42 AB2C4D30E42 31.14 1.03 -6.31 -0.84 -2
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412071 135084934 1 PdBr2N6C15H28 AB2C6D15E28 117.87 17.79 -5.01 -2.21 0
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412072 135084935 3 N2C5H10 A2B5C10 47.94 2.35 -8.66 0.56 0
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412073 135084936 1 IO6C32H41 AB6C32D41 -271.94 3.18 -9.04 -0.89 0
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412074 135084937 1 OAu2N4C54H80 AB2C4D54E80 66.87 20.13 -7.0 -1.12 0
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412075 135084938 1 ORhN2C30H43 ABC2D30E43 -38.86 14.74 -9.2 -2.87 0
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412076 135084939 2 NC14H20 AB14C20 19.04 2.33 -7.95 0.31 -1
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412078 135084941 1 AuClNC25H38 ABCD25E38 14.01 11.72 0.0 0.0 -1
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412080 135084946 1 SiN5C32H49 AB5C32D49 6.5 7.13 -8.49 -0.27 -1
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412081 135084947 1 PdN2O5F6C25H29 AB2C5D6E25F29 -456.37 5.9 0.0 0.0 0
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412082 135084948 1 N2C27H36 A2B27C36 40.6 1.4 -8.68 0.37 -2
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412083 135084949 1 B2Cu3N12C24H38 A2B3C12D24E38 240.98 5.59 0.0 0.0 -1
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412086 135084952 1 OPdCl2N3C39H62 ABC2D3E39F62 28.58 2.63 0.0 0.0 0
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412087 135084953 1 ClCuN2C16H17 ABC2D16E17 78.79 7.95 0.0 0.0 0
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412088 135084954 1 AuON3H30C37 ABC3D30E37 309.64 6.02 -6.94 -1.74 0