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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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84068 49863985 2 O3C14H17 A3B14C17 -187.64 7.64 -9.52 -0.33 0
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84069 49863987 1 NOF3H24C25 ABC3D24E25 -120.13 3.04 -8.79 -0.8 0
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84070 49863989 1 O2C19H30 A2B19C30 -96.48 5.01 -8.79 0.14 0
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84071 49863991 1 O17H28C32 A17B28C32 -664.71 2.29 -8.89 -1.52 0
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84072 49863996 1 FNO4H14C18 ABC4D14E18 -135.03 5.57 -8.63 -1.0 0
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84073 49863998 1 NF3O4H14C19 AB3C4D14E19 -249.54 6.83 -8.81 -1.1 0
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84074 49863999 1 BrN2O2H21C24 AB2C2D21E24 -1.2 4.51 -9.06 -0.95 0
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84075 49864003 1 NO3C26H33 AB3C26D33 -113.67 3.18 -9.09 -1.4 0
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84076 49864007 1 ClOSN6H19C20 ABCD6E19F20 92.32 9.28 -9.56 -1.68 0
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84077 49864008 1 ClSO2N6H21C22 ABC2D6E21F22 55.35 3.31 -8.96 -1.58 0
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84078 49864010 1 NO4H15C17 AB4C15D17 -77.51 3.37 -8.35 -0.72 0
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84079 49864014 1 N2O3H26C31 A2B3C26D31 -8.78 2.7 -9.25 -0.97 0
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84080 49864017 1 ClNO3C24H28 ABC3D24E28 -108.71 2.77 -9.08 -1.32 0
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84081 49864020 1 FON2H27C28 ABC2D27E28 20.42 3.92 -8.8 -1.08 0
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84082 49864022 1 PN4O16C20H31 AB4C16D20E31 -743.73 13.02 -9.37 -1.02 0
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84083 49864024 1 NF3O3H12C17 AB3C3D12E17 -201.15 4.16 -8.63 -1.07 0
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84084 49864040 1 ClN2O5C26H31 AB2C5D26E31 -125.12 9.47 -9.67 -1.43 0
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84085 49864075 1 NO3C16H25 AB3C16D25 -141.36 1.71 -8.59 0.06 0
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84086 49864079 1 O7N8C42H64 A7B8C42D64 -336.52 6.01 -9.22 0.09 0
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84087 49864080 1 O7N8C43H66 A7B8C43D66 -334.38 3.32 -9.31 0.0 0
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84088 49864084 1 PN2O9C19H29 AB2C9D19E29 -417.35 3.97 -9.24 -0.38 0
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84089 49864087 3 N2C7H8 A2B7C8 117.35 11.08 -8.51 -0.65 0
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84090 49864090 2 N2O2H8C9 A2B2C8D9 -39.16 7.08 -9.22 -1.16 0
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84091 49864092 1 PN2O9C18H27 AB2C9D18E27 -412.43 6.38 -9.36 -0.3 0
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84092 49864093 1 PN2O9C19H29 AB2C9D19E29 -420.14 6.06 -9.26 -0.07 0