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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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376920 134222953 1 NC11H21 AB11C21 -39.22 2.13 -9.2 3.41 0
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376921 134222954 1 NC13H25 AB13C25 -16.49 1.59 -8.84 1.54 0
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376922 134222955 1 NC21H35 AB21C35 18.44 2.0 -8.57 0.5 0
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376923 134222956 1 N2O31C46H82 A2B31C46D82 -1437.84 12.06 -9.71 0.27 0
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376924 134222957 1 SN4H34C47 AB4C34D47 339.85 13.18 -7.6 -1.77 0
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376925 134222958 1 FO3N9H24C25 AB3C9D24E25 -17.56 11.75 -9.1 -1.14 0
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376926 134222959 1 NC15H25 AB15C25 13.54 1.94 -8.03 0.46 0
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376927 134222960 1 NC15H23 AB15C23 -7.3 1.31 -8.32 0.53 0
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376928 134222961 1 SN4H30C46 AB4C30D46 246.63 2.69 -8.14 -0.69 0
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376929 134222962 1 N7O9C42H81 A7B9C42D81 -463.39 1.93 -8.27 0.59 0
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376930 134222963 1 F2O3N7C33H33 A2B3C7D33E33 -55.11 6.74 -9.39 -1.18 0
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376931 134222964 1 FO5N8H27C28 AB5C8D27E28 -81.54 8.18 -9.44 -1.22 0
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376932 134222965 1 ClNOC10H12 ABCD10E12 -29.74 1.94 -9.46 -0.13 0
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376933 134222966 1 NOC11H15 ABC11D15 -39.07 3.38 -9.13 0.16 0
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376934 134222967 1 ClNOC10H12 ABCD10E12 -39.09 1.39 -9.43 -0.36 0
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376935 134222968 1 NOCl2C10H11 ABC2D10E11 -44.83 2.87 -9.55 -0.65 0
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376936 134222969 1 ClNOC10H12 ABCD10E12 -29.95 3.45 -9.32 -0.2 0
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376937 134222970 1 NOC11H15 ABC11D15 -36.81 3.08 -9.1 0.14 0
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376938 134222971 1 NOC11H15 ABC11D15 -35.91 2.74 -9.22 0.12 0
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376939 134222972 1 ClNOC10H12 ABCD10E12 -39.2 2.57 -9.56 -0.35 0
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376940 134222973 1 NOC14H15 ABC14D15 -9.0 1.49 -8.79 -0.43 0
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376941 134222974 1 NO2C12H17 AB2C12D17 -76.63 3.98 -8.72 0.07 0
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376942 134222975 1 FNOC10H12 ABCD10E12 -76.95 2.02 -9.51 -0.34 0
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376943 134222977 1 NOC11H15 ABC11D15 -35.73 2.32 -9.21 0.12 0
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376944 134222978 1 ClNOC10H12 ABCD10E12 -30.05 4.09 -9.39 -0.17 0
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376945 134222979 1 FNOC10H12 ABCD10E12 -67.91 2.38 -9.36 -0.17 0
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376946 134222980 1 NOC11H15 ABC11D15 -38.01 2.69 -9.27 0.15 0
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376947 134222981 1 NO2C12H17 AB2C12D17 -74.37 3.71 -8.73 0.06 0
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376948 134222982 1 ClNOC10H12 ABCD10E12 -30.28 2.02 -9.29 -0.2 0
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376949 134222983 1 NOC12H17 ABC12D17 -46.19 3.27 -9.09 0.22 0
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376950 134222984 1 NO2H27C42 AB2C27D42 124.65 1.17 -7.7 -0.64 0
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376951 134222985 1 ClNOC10H12 ABCD10E12 -38.93 3.26 -9.46 -0.34 0
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376952 134222986 1 NOC11H15 ABC11D15 -39.15 3.47 -9.15 0.24 0
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376953 134222987 1 NOC11H15 ABC11D15 -39.96 3.4 -9.13 0.22 0
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376954 134222988 1 NOCl2C9H9 ABC2D9E9 -34.87 2.2 -9.61 -0.67 0
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376955 134222989 1 NOCl2C9H9 ABC2D9E9 -29.76 2.29 -9.46 -0.52 0
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376956 134222991 1 NOC13H13 ABC13D13 -2.23 1.7 -8.87 -0.53 0
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376957 134222992 1 NOC11H15 ABC11D15 -31.25 1.48 -9.01 0.42 0
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376958 134222993 1 NOC11H15 ABC11D15 -31.32 0.72 -9.11 0.33 0
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376959 134222994 1 NOC11H15 ABC11D15 -29.3 3.33 -9.07 0.2 0
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376960 134222995 1 NOC11H15 ABC11D15 -29.82 3.24 -8.89 0.18 0
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376961 134222996 1 NOCl2C10H11 ABC2D10E11 -33.69 0.92 -9.21 -0.59 0
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376962 134222997 1 ClNOC10H12 ABCD10E12 -29.87 2.32 -9.14 -0.13 0
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376963 134222998 1 NOC12H17 ABC12D17 -33.69 3.36 -8.9 0.28 0
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376964 134222999 1 ClNOC10H12 ABCD10E12 -28.01 2.04 -8.98 -0.12 0
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376965 134223000 1 ClNOC10H12 ABCD10E12 -29.63 3.25 -9.32 -0.28 0
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376966 134223001 1 NO2C11H15 AB2C11D15 -59.79 2.01 -8.73 0.19 0
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376967 134223002 1 NOC11H15 ABC11D15 -35.49 3.16 -9.15 0.2 0
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376968 134223003 1 NOCl2C10H11 ABC2D10E11 -34.08 2.9 -9.12 -0.43 0
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376969 134223004 1 NOC11H15 ABC11D15 -25.54 1.97 -9.02 0.35 0