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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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379870 134961899 1 NCl2H19C21 AB2C19D21 35.22 2.27 -9.29 -0.72 0
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379871 134962332 1 OF10H14C18 AB10C14D18 -501.62 4.05 -9.42 -0.46 0
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379872 134963428 1 NOC14H19 ABC14D19 -41.57 2.81 -9.23 0.41 0
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379873 134963500 1 ON2C17H30 AB2C17D30 -65.08 3.58 -9.19 0.76 0
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379874 134963508 1 O2C15H16 A2B15C16 -41.65 1.92 -9.43 -0.07 0
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379875 134963513 1 SSiF3O3C10H19 ABC3D3E10F19 -319.3 4.1 -8.92 -1.19 0
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379876 134963531 1 BrO2C11H19 AB2C11D19 -125.44 3.94 -9.86 0.03 0
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379877 134963533 2 O2Si2C3H11 A2B2C3D11 -460.99 3.12 -9.86 0.99 0
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379879 134963547 1 NO2C8H15 AB2C8D15 -108.59 6.11 -9.53 0.9 0
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379880 134963550 1 IOC15H15 ABC15D15 15.64 1.34 -8.69 -0.82 0
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379881 134963554 1 OC12H22 AB12C22 -69.64 3.11 -9.89 0.76 0
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379882 134963567 1 O2C11H16 A2B11C16 -71.15 2.0 -9.89 0.89 0
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379883 134963582 1 NOSCl2C7H13 ABCD2E7F13 -75.31 1.33 -9.54 -0.09 0
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379884 134963592 1 ClN2C11H13 AB2C11D13 29.72 4.05 -9.44 -0.6 0
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379885 134963614 1 O2C17H20 A2B17C20 -62.09 1.9 -9.62 -0.47 0
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379886 134963660 1 ClNOSiC13H16 ABCDE13F16 -85.51 4.41 -9.07 -0.01 0
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379887 134963677 1 NOC8H13 ABC8D13 -25.07 5.13 -10.44 0.42 0
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379888 134963696 1 ClO2C15H15 AB2C15D15 -21.6 2.57 -9.32 -0.94 0
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379889 134963729 1 SO5C14H18 AB5C14D18 -199.46 5.95 -9.38 -0.82 0
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379890 134963841 1 S2O3C9H12 A2B3C9D12 -113.49 5.82 -9.07 -0.95 0
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379891 134963935 1 NPS2O3C6H10 ABC2D3E6F10 -107.63 4.04 -9.14 -1.11 0
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379893 134964011 1 BrNO2H16C19 ABC2D16E19 3.89 2.07 -8.54 -0.53 0
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379894 134964013 1 O3C9H16 A3B9C16 -149.29 1.85 -9.96 1.62 0
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379895 134964017 1 O3C17H24 A3B17C24 -150.59 2.2 -9.79 -0.26 0
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379897 134964067 1 C17H26 A17B26 -23.92 0.7 -9.19 0.53 1
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379898 134964145 1 N2O4C9H11 A2B4C9D11 -72.02 0.96 0.0 0.0 0
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379899 134964146 1 NO4C10H19 AB4C10D19 -180.66 2.08 -9.52 0.0 0
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379900 134964148 1 NOC11H15 ABC11D15 3.74 2.53 -8.51 0.18 0
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379901 134964149 1 NC13H19 AB13C19 6.83 1.08 -8.68 0.52 0
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379902 134964178 1 SnC17H36 AB17C36 -46.35 0.28 -8.55 0.85 0
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379903 134964179 1 O4H10C11 A4B10C11 -87.87 2.03 -9.83 -0.62 0
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379904 134964181 1 BrO2C10H13 AB2C10D13 -71.49 4.24 -9.92 -0.52 0
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379905 134964182 1 C9H10 A9B10 61.18 0.53 -9.46 0.43 0
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379907 134964184 2 OC5H7 AB5C7 -69.85 2.59 -8.01 0.42 0
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379908 134964187 1 NO3H21C24 AB3C21D24 -44.67 2.35 -8.81 -0.75 0
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379909 134964188 2 OH7C8 AB7C8 -4.17 1.86 -9.4 -0.36 1
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379910 134964197 1 SiN2O3C10H23 AB2C3D10E23 -201.23 3.25 0.0 0.0 0
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379911 134964200 1 NOC15H23 ABC15D23 -39.5 4.03 -7.67 0.74 0
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379912 134964201 1 OC15H22 AB15C22 -43.55 2.09 -8.46 1.16 0
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379913 134964205 1 OC16H24 AB16C24 -54.74 2.19 -8.75 0.25 0
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379914 134964209 1 SN2O5C25H40 AB2C5D25E40 -253.63 4.5 -9.9 -0.24 0
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379915 134964212 1 N3O4C10H15 A3B4C10D15 -96.44 4.22 -9.97 -0.15 0
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379916 134964213 2 N2C7H9 A2B7C9 63.36 1.89 -8.88 0.6 0
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379917 134964215 1 N3C9H13 A3B9C13 50.41 5.01 -9.33 0.69 0
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379918 134964217 1 NBr2O2H9C10 AB2C2D9E10 -35.98 3.17 -10.17 -1.11 0
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379919 134964218 1 NO3C12H15 AB3C12D15 -110.56 4.97 -8.33 -0.44 0
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379920 134964219 1 N2O3C13H14 A2B3C13D14 -10.73 6.16 -9.22 -1.4 0
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379921 134964220 1 NO2C13H23 AB2C13D23 -116.23 6.12 -9.41 1.01 0
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379922 134964221 1 O2C17H18 A2B17C18 -57.54 2.42 -9.3 -0.57 0
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379923 134964335 1 NO5C12H15 AB5C12D15 -128.26 4.71 -10.02 -0.72 0
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379924 134964336 1 NOC13H15 ABC13D15 -4.36 3.0 -9.88 -0.1 -1
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379925 134964337 1 CuNCl2O2C4H4 ABC2D2E4F4 1.65 10.48 -9.52 -0.69 0
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379926 134964338 1 F4H8C11 A4B8C11 -135.65 3.11 -9.6 -0.38 0
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379927 134964339 1 O3C10H14 A3B10C14 -95.52 1.96 -9.57 0.2 0
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379928 134964340 1 BO2C14H23 AB2C14D23 -154.78 2.37 -9.57 1.25 0
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379929 134964349 1 O2C11H12 A2B11C12 -41.42 2.1 -9.68 -0.03 0
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379930 134964352 1 OC19H22 AB19C22 4.2 2.59 -9.51 -0.66 0
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379931 134964353 1 NC18H23 AB18C23 33.77 1.65 -8.73 0.37 0
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379932 134964354 1 NC17H17 AB17C17 33.4 2.31 -8.11 0.27 0
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379933 134964355 1 OC19H22 AB19C22 -18.42 2.74 -9.27 0.32 0
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379934 134964356 1 NH15C17 AB15C17 77.48 4.04 -9.29 -0.29 0
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379935 134964358 1 NO2F3C13H14 AB2C3D13E14 -187.5 3.67 -9.18 -0.78 0
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379936 134964362 1 NSCl2O3C12H13 ABC2D3E12F13 -130.18 6.1 -10.26 -0.67 0
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379937 134964363 2 H8C9 A8B9 70.38 0.48 -8.62 -0.47 0
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379938 134964364 1 OC13H22 AB13C22 -53.46 2.5 -9.0 1.07 0
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379939 134964365 1 OC13H18 AB13C18 -24.24 1.58 -8.74 0.38 0
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379940 134964381 1 NO2C15H15 AB2C15D15 -32.08 4.84 -10.02 -0.6 0
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379941 134964383 4 C4H5 A4B5 22.97 0.98 -8.7 0.06 0
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379942 134964384 1 OC11H18 AB11C18 -47.28 2.22 -9.0 1.06 0
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379943 134964385 2 OC7H9 AB7C9 -86.94 1.28 -9.14 0.45 0
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379944 134964386 1 NO2C16H17 AB2C16D17 -6.36 2.9 -8.78 -0.68 0
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379945 134964387 1 NO2F5H10C12 AB2C5D10E12 -241.27 2.28 -9.21 -1.4 0
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379946 134964388 1 ON2C13H14 AB2C13D14 2.87 3.55 -8.97 -0.82 0
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379947 134964389 1 IOS2H9C15 ABC2D9E15 53.53 3.22 -8.48 -1.13 0
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379948 134964390 1 OC12H14 AB12C14 -24.39 2.24 -9.43 0.34 0
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379949 134964391 1 NOH11C15 ABC11D15 52.05 13.13 -7.76 -1.51 0
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379950 134964392 1 NBr2H11C15 AB2C11D15 55.49 4.27 -8.62 -0.52 0
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379951 134964393 1 FC15H19 AB15C19 -44.33 2.3 -9.06 0.02 0
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379952 134964394 1 NH11C15 AB11C15 112.07 2.93 -9.47 -0.34 0
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379953 134964395 1 ClOC12H15 ABC12D15 -35.08 3.7 -9.37 -0.07 0
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379954 134964396 1 O5C11H16 A5B11C16 -199.9 1.75 -10.39 -0.24 0
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379955 134964397 1 NOSiC16H21 ABCD16E21 -16.68 4.3 -8.25 0.15 0
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379956 134964398 1 NOC16H23 ABC16D23 7.29 3.57 -6.5 -0.3 0
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379957 134964399 1 O2C13H16 A2B13C16 -37.78 4.21 -9.43 0.28 0
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379958 134964400 1 NOF5H26C31 ABC5D26E31 -189.47 4.99 -9.28 -1.11 0
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379959 134964401 1 N2O3C14H18 A2B3C14D18 -85.74 1.44 -8.38 -0.45 0
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379960 134964402 1 NSiO5C11H21 ABC5D11E21 -265.13 5.0 -9.54 0.55 0
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379961 134964403 1 SN2O2C9H18 AB2C2D9E18 -125.65 2.0 -9.27 0.22 0
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379963 134964405 1 NO2C17H33 AB2C17D33 -158.52 6.03 -9.74 1.34 0
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379964 134964406 1 FO2H9C11 AB2C9D11 -70.6 3.61 -8.57 -0.43 0
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379965 134964407 1 FC15H19 AB15C19 -37.6 2.45 -9.32 0.09 0
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379966 134964408 1 O4C13H26 A4B13C26 -232.29 2.3 -10.62 0.76 0
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379967 134964409 1 O3C12H16 A3B12C16 -114.9 2.46 -8.83 0.17 0
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379968 134964410 1 ON2C13H16 AB2C13D16 21.31 5.38 -10.52 -0.03 0
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379969 134964411 2 O2C7H8 A2B7C8 -145.77 0.78 -9.82 -0.66 0
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379970 134964412 1 OC13H22 AB13C22 -64.74 3.38 -10.04 0.78 0
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379971 134964413 1 O2N3C13H27 A2B3C13D27 -132.43 2.65 -9.62 0.94 0
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379972 134964414 1 NO3C13H13 AB3C13D13 -95.43 2.18 -9.39 -0.5 0
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379973 134964415 1 SiO2C15H22 AB2C15D22 -93.38 1.3 -8.74 0.1 0
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379974 134964416 1 SN2O2C7H14 AB2C2D7E14 -58.11 2.17 -9.31 -1.16 0