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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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175941 75970600 1 SCl2O3N5C29H39 AB2C3D5E29F39 -91.55 9.63 -8.89 -0.72 0
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175943 75971121 2 NOC10H12 ABC10D12 -44.34 5.49 -9.12 0.11 0
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175944 75971122 1 N10O11C58H82 A10B11C58D82 -385.46 10.56 -8.85 -0.32 0
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175945 75971123 1 O5H20C26 A5B20C26 -122.97 5.29 -8.95 -1.8 0
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175946 75971124 2 O3H24C26 A3B24C26 -80.29 8.62 -9.24 -1.09 0
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175947 75971283 1 N4O4C33H52 A4B4C33D52 -217.59 4.89 -9.15 0.25 0
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175948 75971565 1 N5O7C30H41 A5B7C30D41 -242.12 3.66 -8.28 -0.39 0
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175949 75971568 1 NO2C12H23 AB2C12D23 -125.58 3.05 -9.61 0.12 0
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175950 75971865 1 O3N4C8H16 A3B4C8D16 -37.67 3.34 -9.74 -1.0 0
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175951 75971870 1 N2O5C28H28 A2B5C28D28 -137.57 5.35 -8.7 -0.35 0
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175952 75973175 1 N4O5C26H32 A4B5C26D32 -132.94 9.23 -8.39 0.05 0
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175953 75973176 1 N4O5C26H32 A4B5C26D32 -140.94 7.59 -8.41 0.05 0
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175954 75973449 1 O2N3C16H19 A2B3C16D19 -31.37 8.0 -9.49 -1.82 0
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175955 75973484 1 NOSC14H21 ABCD14E21 -53.27 0.51 -8.04 -0.39 0
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175956 75973547 1 ON4C19H20 AB4C19D20 84.7 5.21 -9.05 -0.58 0
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175957 75973732 1 FO3N5C23H26 AB3C5D23E26 -101.28 5.3 -8.87 -0.31 0
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175958 75974069 1 ClFO4N5C21H23 ABC4D5E21F23 -142.68 5.0 -9.08 -0.73 0
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175959 75974070 1 FO4N6C25H31 AB4C6D25E31 -124.68 1.34 -8.92 -0.45 0
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175960 75974113 2 ON2C11H16 AB2C11D16 -81.67 1.69 -8.94 0.05 0
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175961 75974124 1 FO2N4C21H29 AB2C4D21E29 -106.05 4.44 -9.41 -0.29 0
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175962 75974125 1 FO2N4C21H29 AB2C4D21E29 -103.52 5.03 -9.49 -0.22 0
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175963 75974126 1 ClFO2N4C21H28 ABC2D4E21F28 -113.86 4.86 -9.35 -0.74 1
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175964 75974595 1 O4N5C24H24 A4B5C24D24 -61.82 3.77 0.0 0.0 1
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175965 75974596 1 N5O5C24H24 A5B5C24D24 -92.23 3.64 0.0 0.0 0
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175966 75975457 1 ON4C16H24 AB4C16D24 -12.2 5.73 -9.11 0.0 1
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175967 75976273 1 O3N4C17H25 A3B4C17D25 -108.9 6.51 0.0 0.0 1
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175968 75976379 1 N4O4C18H21 A4B4C18D21 -100.76 5.99 0.0 0.0 0
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175969 75976428 1 SO4N5C19H21 AB4C5D19E21 -45.39 10.25 -8.6 -1.62 0
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175970 75976595 1 ClO3N5C18H24 AB3C5D18E24 -115.64 5.85 -9.63 -0.36 0
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175971 75976889 1 ClSN2O3C16H23 ABC2D3E16F23 -123.47 5.45 -9.31 -0.59 0
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175972 75976932 1 ON2C16H22 AB2C16D22 -3.72 3.29 -9.13 0.24 0
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175973 75976958 1 SN4O4H20C23 AB4C4D20E23 -39.9 7.58 -8.69 -1.36 0
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175974 75977262 1 O3N4C23H32 A3B4C23D32 -135.57 4.73 -8.3 0.19 0
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175975 75977263 1 FN3O3C22H24 AB3C3D22E24 -145.82 6.43 -9.27 -0.89 0
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175976 75977290 1 N2O4C17H24 A2B4C17D24 -158.87 3.13 -8.46 -0.27 0
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175977 75977291 1 SN2O2C16H22 AB2C2D16E22 -82.26 6.75 -8.4 0.06 0
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175978 75977292 1 F2N2O2C15H18 A2B2C2D15E18 -176.76 5.99 -9.67 -0.78 0
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175979 75977349 1 ClO2N4C20H25 AB2C4D20E25 -18.95 8.07 -9.27 -0.87 0
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175980 75977702 1 O2N5H25C27 A2B5C25D27 73.25 5.07 -8.85 -0.67 0
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175981 75978006 1 SCl2N3H15C16 AB2C3D15E16 63.57 3.25 -9.18 -0.84 0
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175982 75978007 1 ClOSN4H17C18 ABCD4E17F18 42.42 0.43 -8.62 -0.87 0
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175983 75978096 1 BrSN2O2C15H19 ABC2D2E15F19 -74.31 2.76 -9.11 -0.86 0
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175984 75978097 1 SCl2N2O2C15H18 AB2C2D2E15F18 -90.33 5.62 -9.02 -1.04 0
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175985 75978512 1 FSO3N5C21H24 ABC3D5E21F24 -80.58 8.84 -8.72 -0.93 1
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175986 75978513 1 ClSO3N5C21H25 ABC3D5E21F25 -18.78 7.12 0.0 0.0 1
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175987 75978822 1 ON6C19H27 AB6C19D27 50.26 4.89 0.0 0.0 1
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175988 75978901 1 FN3O3C25H35 AB3C3D25E35 -108.02 4.61 0.0 0.0 1
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175989 75978902 1 OF2N3C22H28 AB2C3D22E28 -74.5 2.63 0.0 0.0 0
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175990 75978907 1 O2N8C23H28 A2B8C23D28 24.28 6.72 -8.85 -0.68 1
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175991 75978908 1 O2N6C27H35 A2B6C27D35 10.98 1.23 0.0 0.0 1