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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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136087 51976175 2 NC9H10 AB9C10 45.22 4.96 -8.73 -0.23 0
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136088 51976621 1 ClN2O3C19H21 AB2C3D19E21 -72.28 4.95 -8.39 -0.43 1
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136089 51976986 1 OF3N3C15H21 AB3C3D15E21 -175.2 7.52 0.0 0.0 1
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136090 51977376 1 ClON3C14H21 ABC3D14E21 1.95 3.42 0.0 0.0 0
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136091 51977377 1 ClON3C14H20 ABC3D14E20 -23.9 5.54 -9.0 -0.48 1
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136092 51977378 1 ClON3C14H21 ABC3D14E21 2.62 3.16 0.0 0.0 0
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136093 51977379 1 ClON3C14H20 ABC3D14E20 -22.81 2.15 -8.88 -0.59 0
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136094 51977924 1 ClO2N3C18H24 AB2C3D18E24 -59.43 2.26 -8.83 -0.47 0
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136095 51978130 1 ClON3C22H34 ABC3D22E34 -46.78 4.2 -8.7 -0.33 -1
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136096 51978184 1 N2O4C21H23 A2B4C21D23 -53.44 8.87 0.0 0.0 0
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136097 51978276 1 ON2F3C20H21 AB2C3D20E21 -154.11 6.38 -9.36 -0.66 0
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136098 51978512 1 ClON2C18H19 ABC2D18E19 4.14 3.2 -9.05 -0.57 0
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136099 51978812 1 ClON2C16H21 ABC2D16E21 -35.5 6.08 -8.84 -0.36 0
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136100 51978813 1 ClON2C16H21 ABC2D16E21 -35.57 5.01 -8.91 -0.37 0
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136101 51978814 1 ClON2C16H21 ABC2D16E21 -34.39 6.36 -8.8 -0.27 0
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136102 51978815 1 ClON2C16H21 ABC2D16E21 -34.84 6.77 -8.73 -0.17 0
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136103 51978816 1 ClON2C16H21 ABC2D16E21 -34.41 6.84 -8.76 -0.19 0
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136104 51978817 1 ClN2O2C13H15 AB2C2D13E15 -58.61 4.43 -9.0 -0.6 0
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136105 51979114 1 ClON3C16H16 ABC3D16E16 25.89 3.14 -9.04 -0.52 0
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136106 51979486 1 ClN3C14H18 AB3C14D18 18.86 3.66 -8.96 -0.44 -1
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136107 51979518 1 N2O3C20H21 A2B3C20D21 -18.52 7.75 0.0 0.0 0
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136108 51979537 1 ClON2C13H17 ABC2D13E17 -35.69 2.81 -9.04 -0.52 0
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136109 51979538 1 ClN2C20H23 AB2C20D23 29.2 5.85 -8.83 -0.37 1
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136110 51979981 1 ON3C11H16 AB3C11D16 32.13 9.81 0.0 0.0 1
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136111 51979982 1 NF2C10H14 AB2C10D14 -53.25 3.07 0.0 0.0 1