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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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191956 78208061 1 SO2N3C10H11 AB2C3D10E11 -30.66 3.47 -9.34 -1.39 0
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191957 78208351 1 N2O3C19H24 A2B3C19D24 -100.48 5.17 -8.74 -0.22 0
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191958 78208352 1 SO2N4C17H20 AB2C4D17E20 18.89 3.47 -9.4 -2.28 0
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191959 78208353 1 FN2O2H19C20 AB2C2D19E20 -10.28 4.25 -9.06 -1.53 0
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191960 78208354 2 NOC11H16 ABC11D16 -116.29 5.05 -9.0 0.45 0
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191961 78208355 1 N2O3C16H20 A2B3C16D20 -85.27 10.68 -9.56 -1.91 0
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191962 78208356 1 N2O3C17H22 A2B3C17D22 -37.19 3.81 -8.79 -1.85 0
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191963 78208357 1 N2O2C21H30 A2B2C21D30 -105.58 6.94 -9.39 -0.05 0
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191964 78208358 2 NOC11H16 ABC11D16 -113.11 8.41 -9.16 0.15 0
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191965 78208359 2 NOC11H16 ABC11D16 -108.67 6.64 -9.36 -0.05 0
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191966 78208360 1 N2O5C18H20 A2B5C18D20 -145.39 3.97 -9.34 -1.62 0
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191967 78208361 1 N2O5C16H20 A2B5C16D20 -151.96 11.53 -9.39 -1.76 0
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191968 78208362 1 N2O3C20H28 A2B3C20D28 -137.91 8.25 -9.3 0.26 0
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191969 78208363 1 N2O3C17H22 A2B3C17D22 -94.2 9.56 -9.29 -1.83 0
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191970 78208364 1 N2O2C19H22 A2B2C19D22 -14.56 6.17 -8.86 -0.18 0
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191971 78208365 1 N2O2C19H24 A2B2C19D24 -52.45 5.16 -9.46 -1.68 0
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191972 78208366 2 NOC10H13 ABC10D13 -68.91 3.9 -9.24 -0.46 0
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191973 78208367 1 N2O2C19H24 A2B2C19D24 -58.61 4.62 -9.33 -0.9 0
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191974 78208368 1 N2O2C19H24 A2B2C19D24 -56.97 3.05 -9.2 -0.49 0
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191975 78208383 1 O2N3C17H19 A2B3C17D19 23.12 6.92 -9.32 -2.04 0
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191976 78208502 1 SO2N3C10H15 AB2C3D10E15 -63.05 6.58 -9.46 -1.46 1
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191977 78208523 1 SO2N4C17H21 AB2C4D17E21 -25.23 1.96 0.0 0.0 0
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191978 78208785 1 ON5C18H23 AB5C18D23 54.56 4.4 -8.57 0.01 0
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191979 78208875 1 SN3O3C15H21 AB3C3D15E21 -121.24 3.14 -8.9 -0.48 0
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191980 78208876 1 SO3N4C14H20 AB3C4D14E20 -110.21 3.34 -8.74 -0.48 1