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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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176877 76107104 1 N4O8C17H22 A4B8C17D22 -254.72 2.95 -9.53 -0.45 0
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176878 76107201 3 N2O3C9H12 A2B3C9D12 -280.81 12.76 -9.35 -1.01 0
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176879 76107211 1 SN3O4H9C10 AB3C4D9E10 -103.53 2.05 -9.1 -0.83 0
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176880 76107212 1 O9N10C38H48 A9B10C38D48 -274.52 7.54 -9.68 -1.38 0
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176881 76107213 1 O2N5C19H25 A2B5C19D25 -3.45 4.53 -8.9 -0.31 0
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176882 76107214 1 N2O2H6C9 A2B2C6D9 54.08 5.45 -9.65 -1.81 0
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176883 76107219 1 N2O3C9H18 A2B3C9D18 -142.56 2.15 -9.82 -0.5 1
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176884 76107594 1 S2O5N7C20H22 A2B5C7D20E22 -27.55 8.97 0.0 0.0 1
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176885 76107943 1 ClNSO2C24H27 ABCD2E24F27 -50.13 4.12 0.0 0.0 0
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176886 76108057 1 ON3C21H27 AB3C21D27 44.61 4.18 -7.89 -0.63 0
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176887 76108100 1 SN4O4C10H12 AB4C4D10E12 -83.67 2.96 -9.7 -1.21 0
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176888 76108101 1 O2N3C16H29 A2B3C16D29 -96.79 1.93 -9.29 -0.67 0
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176889 76108102 1 O4C19H30 A4B19C30 -239.62 3.28 -9.76 0.69 0
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176890 76108103 1 FO5C26H31 AB5C26D31 -246.21 3.6 -8.98 -0.62 0
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176891 76108104 1 NSO7C9H17 ABC7D9E17 -296.87 3.21 -9.59 -1.28 0
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176892 76108105 2 N2O3C12H12 A2B3C12D12 -95.06 7.51 -8.46 -1.74 1
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176893 76108106 1 N3O4C7H8 A3B4C7D8 -90.93 6.58 0.0 0.0 0
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176894 76108107 1 FNC18H20 ABC18D20 -3.78 2.2 -9.1 -0.11 0
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176895 76108108 1 N2O5C27H30 A2B5C27D30 -106.19 7.03 -8.9 -0.69 0
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176896 76108109 1 O3N5C18H27 A3B5C18D27 -104.48 5.26 -9.36 0.36 0
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176897 76108110 1 N2O2C29H44 A2B2C29D44 -120.78 4.13 -8.72 0.18 1
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176898 76108111 1 ON3H16C18 AB3C16D18 59.29 1.56 0.0 0.0 0
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176899 76108143 1 SN2O2C40H42 AB2C2D40E42 -4.53 2.53 -8.17 -0.26 0
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176900 76108144 1 N2O3F4H4C9 A2B3C4D4E9 -256.2 3.77 -10.28 -2.35 0
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176901 76108318 1 F3O4C17H21 A3B4C17D21 -340.31 3.2 -8.93 0.06 1