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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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402394 135055825 1 NSO3C20H21 ABC3D20E21 -46.09 7.91 -8.47 -0.6 0
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402395 135055827 1 NO3C20H21 AB3C20D21 -74.01 6.25 -9.22 -1.5 0
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402396 135055833 1 OSi2C20H30 AB2C20D30 -54.07 1.06 -8.32 0.09 0
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402397 135055836 1 FNO2H18C22 ABC2D18E22 -52.4 5.86 -9.76 -0.58 0
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402398 135055846 1 O5C17H24 A5B17C24 -199.04 3.97 -9.48 0.43 0
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402399 135055848 1 N3O6C21H31 A3B6C21D31 -242.84 8.09 -9.28 -0.58 0
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402400 135055849 1 N2O5C13H24 A2B5C13D24 -235.2 1.63 -9.32 -0.26 0
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402401 135055850 1 SiO3C27H36 AB3C27D36 -128.38 1.91 -9.13 -0.03 0
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402402 135055852 1 NO4C13H15 AB4C13D15 -59.65 2.26 -9.65 -0.66 0
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402403 135055855 1 NSO3C25H27 ABC3D25E27 -35.93 6.3 -9.09 -0.29 0
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402404 135055858 1 O3C18H20 A3B18C20 -68.5 3.02 -8.81 -0.08 0
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402405 135055859 2 O2C9H11 A2B9C11 -138.59 6.53 -8.79 0.33 0
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402406 135055860 1 O2N3C25H31 A2B3C25D31 45.08 1.5 -8.6 -0.13 0
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402407 135055861 1 FON3C24H28 ABC3D24E28 39.8 2.48 -8.89 -0.12 0
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402408 135055862 1 FON3C24H28 ABC3D24E28 36.59 2.04 -8.91 -0.15 0
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402409 135055864 1 NO4C19H29 AB4C19D29 -199.14 0.99 -9.21 0.17 0
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402410 135055865 2 OC8H8 AB8C8 -33.28 1.18 -9.08 -0.63 0
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402411 135055866 1 BrOH13C15 ABC13D15 8.83 2.41 -9.62 -0.92 0
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402412 135055874 1 FOSiC12H23 ABCD12E23 -151.39 4.5 -9.06 0.78 0
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402413 135055885 1 BrNO3C18H20 ABC3D18E20 -86.89 0.72 -8.24 -0.54 0
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402414 135055889 1 O3C15H22 A3B15C22 -130.78 5.48 -8.74 0.26 0
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402415 135055894 1 ClFO2H10C11 ABC2D10E11 -105.31 3.77 -9.77 -0.57 0
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402416 135055901 1 IN2O7H17C20 AB2C7D17E20 -109.84 9.14 -9.24 -1.42 0
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402417 135055902 1 N2F3O7H17C21 A2B3C7D17E21 -288.48 6.82 -9.29 -1.52 0
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402418 135055903 2 NO2C9H14 AB2C9D14 -132.0 6.15 -9.41 -0.37 0
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402419 135055906 1 NO3C15H23 AB3C15D23 -156.39 2.8 -9.42 0.03 0
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402420 135055908 1 SN2O6C29H40 AB2C6D29E40 -193.85 4.81 -8.49 -0.71 0
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402421 135055910 2 NO3C16H20 AB3C16D20 -175.33 3.77 -9.05 -0.7 0
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402422 135055911 1 ClN2O6C29H39 AB2C6D29E39 -203.85 3.67 -9.57 -0.75 0
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402423 135055912 1 NCl3O4C17H18 AB3C4D17E18 -178.17 1.18 -8.81 -0.71 0
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402424 135055914 2 OC8H8 AB8C8 -50.3 2.71 -9.26 -0.05 0
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402425 135055916 1 NO3C20H29 AB3C20D29 -123.26 0.97 -7.92 -0.17 0
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402426 135055920 1 SN2O6C14H18 AB2C6D14E18 -166.33 3.8 -10.14 -2.0 0
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402427 135055921 2 NSO2H10C11 ABC2D10E11 -86.07 8.48 -8.51 -0.63 0
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402428 135055930 1 Cl2O3C8H10 A2B3C8D10 -134.03 2.01 -10.3 -1.01 0
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402429 135055932 1 Cl2O2H12C13 A2B2C12D13 -72.72 2.52 -9.87 -0.67 0
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402430 135055933 1 NOCl2C14H15 ABC2D14E15 -39.84 1.18 -9.55 -0.47 0
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402431 135055934 1 SiO3C20H30 AB3C20D30 -156.27 2.6 -8.75 -0.7 0
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402432 135055935 1 O3C15H20 A3B15C20 -104.24 2.09 -9.42 0.29 0
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402433 135055941 1 ClO3C14H17 AB3C14D17 -118.3 2.31 -9.58 -0.46 0
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402434 135055944 1 ClN2O3C20H21 AB2C3D20E21 -82.33 5.17 -8.91 -0.38 0
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402435 135055950 1 N3O5C22H29 A3B5C22D29 -126.85 9.65 -8.83 -0.71 0
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402436 135055951 1 NSO3C20H29 ABC3D20E29 -124.25 6.06 -9.19 -0.24 0
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402437 135055952 1 NSO3C16H23 ABC3D16E23 -86.54 6.17 -8.88 -0.29 0
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402438 135055961 1 N2O4C21H26 A2B4C21D26 -92.42 5.74 -9.44 -0.23 0
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402439 135055962 1 N2O4C15H22 A2B4C15D22 -118.97 6.23 -9.57 -0.3 0
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402440 135055963 1 IO2C14H17 AB2C14D17 -68.9 5.96 -9.45 -0.92 0
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402441 135055964 1 NF4O5C24H25 AB4C5D24E25 -395.62 6.61 -10.17 -0.72 0
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402442 135055977 3 OC4H6 AB4C6 -148.14 4.2 -10.07 -0.25 0
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402443 135055978 1 NO5H15C18 AB5C15D18 -55.99 5.02 -8.87 -0.75 -1