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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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376970 134223005 1 NOC11H15 ABC11D15 -28.22 2.78 -8.91 0.17 0
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376971 134223006 1 NOC12H17 ABC12D17 -36.39 3.39 -8.85 0.25 0
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376972 134223007 1 NOC11H15 ABC11D15 -37.47 3.16 -9.12 0.18 0
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376973 134223008 1 ClNOC10H12 ABCD10E12 -27.65 1.48 -9.08 -0.28 0
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376974 134223009 1 NO2C11H15 AB2C11D15 -60.37 3.84 -8.85 0.05 0
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376975 134223010 1 FO4N8C23H27 AB4C8D23E27 -108.45 10.44 -9.22 -1.05 0
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376976 134223011 1 FNOC11H14 ABCD11E14 -80.74 2.05 -9.51 -0.34 0
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376977 134223012 1 NOC12H17 ABC12D17 -41.43 1.79 -9.12 0.29 0
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376978 134223013 1 ClNOC10H12 ABCD10E12 -37.29 3.46 -9.4 -0.24 0
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376979 134223014 1 ClNOC10H12 ABCD10E12 -39.6 2.86 -9.39 -0.26 0
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376980 134223015 1 NO2C11H15 AB2C11D15 -68.39 4.13 -8.88 0.01 0
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376981 134223016 1 NO2C11H15 AB2C11D15 -67.69 3.75 -8.89 0.01 0
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376982 134223017 1 NO2C11H15 AB2C11D15 -60.69 3.07 -8.74 0.12 0
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376983 134223018 1 NO2C11H15 AB2C11D15 -69.76 4.07 -8.88 -0.02 0
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376984 134223019 1 NOC11H15 ABC11D15 -33.91 2.8 -9.32 0.19 0
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376985 134223020 1 NOC11H15 ABC11D15 -34.28 2.52 -9.31 0.18 0
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376986 134223021 1 NOC11H15 ABC11D15 -36.11 2.72 -9.11 0.19 0
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376987 134223022 1 NOC14H17 ABC14D17 -14.75 3.11 -9.18 0.2 0
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376988 134223023 1 NOC11H15 ABC11D15 -38.25 2.79 -9.1 0.15 0
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376989 134223024 1 NOC14H17 ABC14D17 -15.0 3.37 -9.18 0.2 0
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376990 134223025 1 NOC14H17 ABC14D17 -15.0 3.44 -9.17 0.2 0
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376991 134223026 1 NOC14H17 ABC14D17 -14.75 3.28 -9.17 0.2 0
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376992 134223027 1 ClNOC10H12 ABCD10E12 -36.15 2.75 -9.44 -0.21 0
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376993 134223028 1 FNOC10H12 ABCD10E12 -74.07 2.61 -9.49 -0.14 0
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376994 134223029 1 NOC11H15 ABC11D15 -31.55 1.78 -9.28 0.22 0
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376995 134223030 1 NOC11H15 ABC11D15 -32.79 2.62 -9.33 0.06 0
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376996 134223031 1 NOC11H15 ABC11D15 -31.43 2.32 -9.29 0.06 0
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376997 134223032 1 FNOC11H14 ABCD11E14 -72.71 2.29 -9.28 -0.2 0
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376998 134223033 1 NOC11H15 ABC11D15 -35.36 1.17 -9.18 0.24 0
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376999 134223034 1 NOC11H15 ABC11D15 -35.99 2.02 -9.15 0.28 0
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377000 134223035 1 NOC13H19 ABC13D19 -42.79 1.85 -9.27 0.23 0
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377001 134223036 1 NOC13H19 ABC13D19 -46.88 1.82 -9.11 0.3 0
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377002 134223037 1 NOC13H19 ABC13D19 -41.87 1.83 -9.23 0.24 0
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377003 134223038 1 NOC13H19 ABC13D19 -45.87 1.63 -9.09 0.33 0
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377004 134223039 1 NOC11H15 ABC11D15 -36.05 2.2 -9.26 0.26 0
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377005 134223040 1 NOC11H15 ABC11D15 -35.34 3.14 -9.28 0.09 0
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377006 134223041 1 NOC11H15 ABC11D15 -26.37 2.5 -8.93 0.14 0
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377007 134223042 1 NOC12H17 ABC12D17 -36.77 1.84 -9.28 0.22 0
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377008 134223043 1 N2O3C14H20 A2B3C14D20 -117.33 4.85 -9.11 -0.1 0
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377009 134223044 1 FNOC10H12 ABCD10E12 -69.03 1.91 -9.45 0.12 0
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377010 134223045 1 NOF2C10H11 ABC2D10E11 -122.31 2.32 -9.69 -0.13 0
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377011 134223046 1 NOC13H19 ABC13D19 -38.44 1.49 -8.87 0.31 0
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377012 134223047 1 NOC13H19 ABC13D19 -38.46 1.54 -8.87 0.32 0
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377013 134223048 1 NOC13H15 ABC13D15 30.19 3.19 -9.13 0.01 0
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377014 134223049 1 NOC12H17 ABC12D17 -31.79 1.38 -8.89 0.29 0
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377015 134223050 1 NOC13H19 ABC13D19 -35.72 1.61 -8.74 0.35 0
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377016 134223051 1 NOC12H13 ABC12D13 24.74 1.51 -9.2 0.22 0
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377017 134223052 1 FNOC10H12 ABCD10E12 -69.64 1.63 -9.51 0.03 0
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377018 134223053 1 N2O3C16H24 A2B3C16D24 -115.6 4.05 -8.54 -0.01 0
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377019 134223054 1 N2O3C15H22 A2B3C15D22 -103.64 5.49 -8.82 0.12 0