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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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213845 81065476 1 ClN2O2C12H13 AB2C2D12E13 -54.58 1.78 -8.91 -0.88 0
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213846 81065477 2 NOC6H7 ABC6D7 -50.59 7.06 -8.77 -0.38 0
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213847 81065478 1 ClN2O3C15H21 AB2C3D15E21 -145.58 5.2 -9.57 -0.24 0
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213848 81065479 1 ClN2O3C15H21 AB2C3D15E21 -146.13 2.89 -9.58 -0.25 0
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213849 81065480 1 ClN2O3C15H21 AB2C3D15E21 -145.67 2.96 -9.53 -0.3 0
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213850 81065481 1 BrN2O3C15H21 AB2C3D15E21 -134.28 2.71 -9.56 -0.32 0
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213851 81065482 1 N3O4C12H13 A3B4C12D13 -47.2 7.88 -9.77 -1.93 0
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213852 81065483 1 NSO4C13H19 ABC4D13E19 -169.36 6.41 -9.41 -0.56 0
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213853 81065484 1 O2N3C11H17 A2B3C11D17 -76.4 2.03 -9.26 -0.2 0
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213854 81065485 1 SN3O3C14H23 AB3C3D14E23 -144.83 3.79 -9.22 -0.43 0
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213855 81065486 1 SN3O4C12H13 AB3C4D12E13 -55.04 4.21 -9.1 -1.63 0
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213856 81065487 1 O2N5C7H13 A2B5C7D13 -20.33 5.11 -9.75 -0.24 0
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213857 81065488 1 SN2O3C15H24 AB2C3D15E24 -139.6 3.22 -9.2 -0.3 0
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213858 81065489 1 N2O3C16H30 A2B3C16D30 -190.48 3.36 -9.7 0.5 0
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213859 81065490 2 ON3C5H7 AB3C5D7 28.66 10.32 -9.72 -1.45 0
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213860 81065491 1 N2O5C13H18 A2B5C13D18 -142.58 3.92 -9.29 -0.96 0
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213861 81065492 2 N2O2C6H7 A2B2C6D7 -47.97 8.38 -9.92 -1.6 0
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213862 81065493 1 N2O3C14H20 A2B3C14D20 -142.21 4.82 -8.83 -0.41 0
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213863 81065494 1 N3O3C12H19 A3B3C12D19 -111.3 5.3 -8.75 -0.15 0
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213864 81065495 1 BrN2O4C12H15 AB2C4D12E15 -90.73 3.17 -9.58 -1.6 0
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213865 81065496 1 N2O5C13H18 A2B5C13D18 -129.44 10.64 -9.33 -1.4 0
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213866 81065497 1 O2N3C12H15 A2B3C12D15 -44.06 3.69 -9.14 -0.72 0
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213867 81065498 2 N2O2C5H7 A2B2C5D7 -69.46 8.9 -10.12 -1.62 0
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213868 81065499 1 NO4C15H17 AB4C15D17 -140.22 3.17 -9.52 -0.74 0
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213869 81065500 1 NSO3C12H17 ABC3D12E17 -130.53 3.8 -9.22 -0.72 0
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213870 81065501 1 NO3C11H19 AB3C11D19 -144.81 3.45 -9.81 0.57 0
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213871 81065502 1 ClN2O5C13H15 AB2C5D13E15 -135.62 3.0 -10.32 -1.9 0
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213872 81065503 1 N2O3C16H20 A2B3C16D20 -115.6 5.09 -8.64 -0.15 0
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213873 81065504 1 ClNSO3C15H20 ABCD3E15F20 -137.64 3.06 -8.96 -0.6 0
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213874 81065505 1 FN2O5C13H15 AB2C5D13E15 -170.89 6.73 -10.26 -1.73 0
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213875 81065506 1 NSO3C16H23 ABC3D16E23 -135.82 2.53 -8.56 -0.09 0
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213876 81065507 2 NO2C7H13 AB2C7D13 -224.5 6.4 -9.87 0.58 0
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213877 81065508 1 NF3O3C10H16 AB3C3D10E16 -326.43 4.93 -10.17 0.5 0
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213878 81065509 1 NO4C11H21 AB4C11D21 -206.03 3.98 -9.96 0.52 0
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213879 81065510 1 NSO5C14H19 ABC5D14E19 -206.66 6.56 -10.23 -1.05 0
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213880 81065511 1 N3O3C15H25 A3B3C15D25 -137.95 2.14 -8.96 0.56 0
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213881 81065512 1 SN2O4C14H20 AB2C4D14E20 -170.09 4.21 -9.64 -1.1 0
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213882 81065513 1 N2S2O3C14H22 A2B2C3D14E22 -131.62 3.61 -8.82 -0.46 0
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213883 81065514 1 BrNO3C14H18 ABC3D14E18 -131.01 4.09 -9.6 -0.36 0
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213884 81065515 1 BrFNO3C13H15 ABCD3E13F15 -167.87 1.73 -10.18 -1.02 0
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213885 81065516 1 NO4C14H19 AB4C14D19 -177.5 3.64 -9.11 -0.12 0
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213886 81065517 1 SN3O3C13H21 AB3C3D13E21 -113.15 5.19 -9.91 -1.35 0
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213887 81065518 1 NO3C9H15 AB3C9D15 -133.5 3.67 -9.87 -0.07 0
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213888 81065519 1 ClN2O5C13H15 AB2C5D13E15 -135.07 3.47 -10.38 -2.01 0
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213889 81065520 1 NO5C15H21 AB5C15D21 -198.92 4.16 -8.78 -0.36 0
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213890 81065521 1 FNO4C15H20 ABC4D15E20 -215.08 2.68 -9.05 -0.07 0
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213891 81065522 1 ClNSO3C15H20 ABCD3E15F20 -140.73 3.56 -8.79 -0.52 0
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213892 81065523 1 ClNO4C13H16 ABC4D13E16 -178.07 2.41 -9.57 -0.69 0
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213893 81065524 1 N2O4C11H16 A2B4C11D16 -137.06 3.34 -10.02 -0.42 0
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213894 81065525 1 O3N4C11H18 A3B4C11D18 -102.09 2.34 -10.44 -0.1 0