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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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143939 53284522 1 NO3C22H29 AB3C22D29 -120.89 4.79 -8.7 0.21 0
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143940 53284523 1 NO3C22H23 AB3C22D23 -73.35 3.43 -8.47 -0.62 0
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143941 53284691 1 OCl2N2C17H24 AB2C2D17E24 -67.0 4.31 -8.73 -0.35 0
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143942 53284696 1 FOCl2N2C20H21 ABC2D2E20F21 -68.78 3.18 -8.76 -0.34 0
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143943 53285221 1 ClFSN2O3C18H20 ABCD2E3F18G20 -150.36 6.59 -8.92 -0.14 0
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143944 53285222 1 ClSN2O4C21H27 ABC2D4E21F27 -154.19 5.46 -8.79 -0.36 0
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143945 53285794 1 FSN2O3C20H23 ABC2D3E20F23 -131.9 4.35 -9.32 -0.91 0
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143946 53285795 1 SN2O4C21H26 AB2C4D21E26 -126.56 2.94 -9.09 -0.76 0
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143947 53285796 1 SN2O4C23H30 AB2C4D23E30 -141.86 1.84 -8.81 -0.73 0
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143948 53286517 1 SN2O4C21H28 AB2C4D21E28 -142.05 4.79 -8.87 0.06 0
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143949 53286518 1 SN2O3C23H30 AB2C3D23E30 -119.48 5.63 -9.04 0.04 0
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143950 53286554 1 SN2O5C17H22 AB2C5D17E22 -162.58 7.22 -8.96 -0.21 0
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143951 53286596 1 SN2O4C21H28 AB2C4D21E28 -151.34 7.39 -8.6 0.04 0
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143952 53286907 1 SN2F3O3C19H21 AB2C3D3E19F21 -257.75 6.47 -8.86 -0.86 0
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143953 53286936 1 FSN2O4C19H23 ABC2D4E19F23 -182.61 4.32 -8.71 -0.16 0
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143954 53287445 1 SCl2N3O4H19C22 AB2C3D4E19F22 -117.34 6.88 -9.22 -1.02 0
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143955 53287721 1 N2S2O3C23H32 A2B2C3D23E32 -124.26 5.39 -8.66 -0.38 0
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143956 53287838 1 ClSN2O3C22H29 ABC2D3E22F29 -132.87 7.28 -9.01 -0.41 0
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143957 53287914 1 SN2O3F4H16C17 AB2C3D4E16F17 -272.24 4.68 -9.28 -0.51 0
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143958 53287962 1 FSN2O4C16H19 ABC2D4E16F19 -162.68 6.57 -9.17 -0.21 0
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143959 53288138 1 FSN2O3C18H21 ABC2D3E18F21 -140.62 4.27 -8.46 -0.4 0
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143960 53288139 1 SF2N2O3C17H18 AB2C2D3E17F18 -180.05 8.68 -8.8 -0.45 0
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143961 53288140 1 FN2S2O3C17H27 AB2C2D3E17F27 -181.51 5.87 -8.77 -0.06 0
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143962 53288264 1 SN2O4C15H24 AB2C4D15E24 -174.51 9.26 -8.41 0.26 0
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143963 53288517 1 FSN2O4C19H23 ABC2D4E19F23 -172.67 4.79 -8.89 -0.32 0
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143964 53288518 1 FSN2O3C21H27 ABC2D3E21F27 -154.19 4.04 -8.91 -0.28 0
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143965 53288521 1 SN2O3C21H28 AB2C3D21E28 -113.51 2.08 -8.64 0.07 0
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143966 53288650 1 FNO2C19H22 ABC2D19E22 -108.02 2.65 -8.9 -0.08 0
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143967 53289123 2 NOC9H11 ABC9D11 -52.46 4.36 -8.87 -0.36 0
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143968 53289143 1 NO2C15H23 AB2C15D23 -103.46 3.57 -8.63 0.22 0
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143969 53289155 1 NO2C17H27 AB2C17D27 -116.96 2.86 -8.92 0.43 0
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143970 53289216 1 NSO4C17H21 ABC4D17E21 -124.47 9.28 -8.6 -0.42 0
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143971 53289262 1 ClN2O2C20H25 AB2C2D20E25 -66.5 3.34 -8.19 -0.08 0
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143972 53289436 1 ClFSN2O3C20H22 ABCD2E3F20G22 -141.1 5.95 -9.63 -0.49 0
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143973 53289437 1 ClSN2O4C21H25 ABC2D4E21F25 -139.23 9.87 -9.22 -0.21 0
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143974 53289438 1 ClSN3O4C24H30 ABC3D4E24F30 -142.02 2.83 -8.48 -0.29 1
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143975 53290178 1 SN4O7H25C29 AB4C7D25E29 -73.67 8.43 0.0 0.0 0
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143976 53290179 1 SN4O5H18C21 AB4C5D18E21 -61.29 7.02 -8.86 -1.66 1
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143977 53290204 1 SO5N6H15C22 AB5C6D15E22 28.85 5.37 0.0 0.0 0
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143978 53290642 1 SN4O5H22C28 AB4C5D22E28 3.22 4.86 -8.76 -1.42 1
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143979 53290643 1 SN4O5H23C28 AB4C5D23E28 -3.79 6.48 0.0 0.0 1
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143980 53291366 1 ClSN3O3H13C16 ABC3D3E13F16 -11.03 5.81 0.0 0.0 1
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143981 53291422 1 SN3O3H16C20 AB3C3D16E20 14.37 6.1 0.0 0.0 1
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143982 53291676 1 O4N6H23C26 A4B6C23D26 37.52 8.35 0.0 0.0 0
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143983 53291681 1 SN3O3C11H11 AB3C3D11E11 -31.44 4.99 -9.07 -0.98 1
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143984 53292050 1 SN3O5C13H14 AB3C5D13E14 -105.4 4.27 0.0 0.0 1
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143985 53292108 1 S2N4O4C24H27 A2B4C4D24E27 -48.36 9.38 0.0 0.0 1
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143986 53292430 1 BrFSN3O3H16C18 ABCD3E3F16G18 -52.81 6.94 0.0 0.0 1
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143987 53292448 1 S2N5O5H22C25 A2B5C5D22E25 -41.91 12.39 0.0 0.0 0
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143988 53292521 1 BrSN3O3C13H14 ABC3D3E13F14 -69.81 4.36 -9.3 -1.64 1