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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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59851 24899836 1 BrN3O3F4C28H30 AB3C3D4E28F30 -307.61 5.89 -8.38 -1.95 0
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59852 24899854 1 NO5C15H21 AB5C15D21 -219.89 5.23 -8.38 -0.07 0
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59853 24899860 1 NO6C13H17 AB6C13D17 -177.77 5.58 -9.97 -1.14 0
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59854 24899868 1 SCl2O3N4H22C25 AB2C3D4E22F25 -27.18 4.57 -8.95 -0.43 0
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59855 24899874 1 O2N3C93H103 A2B3C93D103 241.82 4.82 -8.21 -0.67 0
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59856 24899894 1 NSSiO3C19H29 ABCD3E19F29 -65.79 5.94 -8.85 -0.43 0
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59857 24900040 1 BrSCl2N3O4C32H32 ABC2D3E4F32G32 -101.67 8.5 -8.98 -1.15 0
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59858 24900390 1 N7O9C28H41 A7B9C28D41 -402.51 3.12 -8.68 -0.22 0
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59859 24900394 1 NO4C37H67 AB4C37D67 -253.05 4.23 -9.13 0.4 0
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59860 24900426 1 SN3O3C27H31 AB3C3D27E31 -79.57 5.19 -8.61 -0.3 0
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59861 24900443 1 O2N7C32H41 A2B7C32D41 23.51 6.15 -8.34 -0.4 0
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59862 24900475 1 O2N3C29H37 A2B3C29D37 -56.56 6.87 -8.48 -0.29 0
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59863 24900490 1 OSCl2N2H12C14 ABC2D2E12F14 10.45 5.57 -8.86 -0.89 0
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59864 24900514 1 O2S2N4C17H28 A2B2C4D17E28 -12.54 5.12 -8.99 -0.85 0
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59865 24900526 1 SN8H22C23 AB8C22D23 201.17 4.02 -8.72 -1.08 0
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59866 24900602 1 S2O11N15C35H65 A2B11C15D35E65 -499.74 9.65 -8.97 -0.72 0
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59867 24900662 1 SN8H12C17 AB8C12D17 210.97 6.48 -9.06 -1.4 0
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59868 24900718 1 ClSN4O5C26H29 ABC4D5E26F29 -163.5 12.47 -8.84 -1.29 0
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59869 24900731 1 FOSN6H17C23 ABCD6E17F23 84.79 2.33 -8.93 -1.59 0
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59870 24900753 1 BrNO3C20H30 ABC3D20E30 -100.7 21.37 -6.44 -0.49 0
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59871 24901196 1 N3O3C22H33 A3B3C22D33 -130.66 8.89 -8.65 -0.2 0
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59872 24901922 1 FCl2N3H4C9 AB2C3D4E9 25.66 2.41 -10.25 -1.63 0
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59873 24901932 1 Cl2N2F3H5C11 A2B2C3D5E11 -104.52 2.44 -10.31 -1.62 0
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59874 24901975 1 ClFN2O2H6C11 ABC2D2E6F11 -62.18 3.7 -10.68 -1.71 0
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59875 24902034 1 OCl2N2H12C17 AB2C2D12E17 40.64 4.41 -9.16 -1.15 0
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59876 24902159 1 ClN2H11C12 AB2C11D12 48.9 2.74 -9.68 -0.88 0
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59877 24902174 1 OCl2N2H10C12 AB2C2D10E12 6.05 4.64 -9.12 -1.12 0
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59878 24902185 1 ClFN2O2H8C12 ABC2D2E8F12 -67.27 0.76 -10.45 -1.68 0
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59879 24902186 1 ClON2C14H15 ABC2D14E15 3.62 2.65 -9.08 -1.1 0
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59880 24902187 1 ClN3O4H8C12 AB3C4D8E12 -23.99 3.42 -10.82 -1.96 0
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59881 24902188 1 ClN2O2H9C12 AB2C2D9E12 -22.1 3.76 -10.19 -1.33 0
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59882 24902190 1 ClON2F3H6C11 ABC2D3E6F11 -140.4 3.01 -10.06 -1.56 0
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59883 24902191 1 ClN2F3H6C11 AB2C3D6E11 -99.93 3.53 -10.39 -1.49 0
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59884 24902203 1 ClFON2H6C11 ABCD2E6F11 -11.98 2.99 -10.31 -1.49 0
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59885 24902207 1 ClN2C14H15 AB2C14D15 36.3 4.29 -9.49 -1.01 0
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59886 24902213 1 ClN3H8C12 AB3C8D12 78.1 5.58 -8.9 -0.92 0
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59887 24902220 1 ClF2O2N3H4C10 AB2C2D3E4F10 -31.4 3.84 -10.88 -2.02 0
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59888 24902238 1 ClN2F3H4C10 AB2C3D4E10 -72.98 2.13 -10.4 -1.45 0
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59889 24902250 1 FN2O2H5C8 AB2C2D5E8 -64.18 1.62 -9.79 -1.29 0
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59890 24902257 1 NO5C22H23 AB5C22D23 -177.42 5.69 -9.01 -0.56 0
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59891 24902265 2 OH2N2C3 AB2C2D3 6.35 1.94 -10.09 -1.78 0
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59892 24902266 1 N2O3H4C6 A2B3C4D6 -48.92 3.07 -9.63 -0.85 0
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59893 24902268 1 NOC12H17 ABC12D17 -47.54 2.7 -9.08 0.39 0
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59894 24902275 1 ON2C15H24 AB2C15D24 -52.12 3.32 -8.82 0.39 0
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59895 24902278 1 N2O3C15H20 A2B3C15D20 -139.84 2.73 -9.71 -0.4 0
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59896 24902280 1 SN2O2C10H14 AB2C2D10E14 -69.22 4.16 -8.72 0.1 0
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59897 24902306 1 ClNOC10H12 ABCD10E12 -14.45 1.52 -8.89 -0.15 0
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59898 24902307 1 ClNOC13H18 ABCD13E18 -41.94 2.36 -8.71 -0.01 0
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59899 24902312 1 BrNOC12H16 ABCD12E16 -31.99 2.27 -8.84 -0.07 0
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59900 24902314 1 BrNOC10H12 ABCD10E12 -2.76 1.51 -8.97 -0.16 0
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59901 24902318 1 BrNOC11H14 ABCD11E14 -6.52 1.74 -8.89 -0.11 0
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59902 24902323 1 FNOC13H18 ABCD13E18 -83.77 1.99 -8.79 -0.05 0
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59903 24902326 1 NOC10H13 ABC10D13 -7.42 1.58 -8.91 0.29 0
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59904 24902327 1 NOC12H17 ABC12D17 -30.85 3.27 -8.8 0.37 0
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59905 24902328 1 NOC11H15 ABC11D15 -10.78 3.16 -8.83 0.34 0
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59906 24902347 1 NO3C15H21 AB3C15D21 -120.59 2.01 -9.12 -0.63 0
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59907 24902354 1 ClNOC10H12 ABCD10E12 -9.91 2.18 -8.97 -0.21 0
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59908 24902359 1 BrNOC12H16 ABCD12E16 -27.26 3.04 -8.96 -0.12 0
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59909 24902365 1 ON2C13H16 AB2C13D16 1.33 4.61 -9.3 -0.52 0
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59910 24902380 1 FNOC12H16 ABCD12E16 -77.93 3.1 -8.91 -0.04 0
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59911 24902382 1 FNOC10H12 ABCD10E12 -48.87 2.8 -8.9 -0.11 0
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59912 24902384 1 FNOC13H18 ABCD13E18 -81.14 2.52 -8.77 0.0 0
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59913 24902385 1 FNOC12H16 ABCD12E16 -72.48 2.38 -8.76 -0.03 0
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59914 24902386 1 FNOC11H14 ABCD11E14 -52.76 2.59 -8.79 -0.03 0
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59915 24902393 1 ClFNOC10H11 ABCDE10F11 -69.41 2.75 -9.18 -0.48 0
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59916 24902436 1 NO3F4C17H21 AB3C4D17E21 -344.23 3.74 -9.55 -0.88 0
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59917 24902442 1 NF2O3C16H21 AB2C3D16E21 -228.19 2.7 -9.44 -0.34 0
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59918 24902443 1 NF2O3C16H21 AB2C3D16E21 -228.01 2.11 -9.45 -0.43 0
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59919 24902444 1 NF2O3C16H21 AB2C3D16E21 -227.02 4.25 -9.51 -0.52 0
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59920 24902467 1 NF3O3C17H22 AB3C3D17E22 -304.96 7.34 -9.44 -0.35 0
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59921 24902478 1 N2O3C15H22 A2B3C15D22 -131.43 2.9 -9.36 -0.16 0
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59922 24902481 1 N2F3O3C16H21 A2B3C3D16E21 -291.42 4.48 -9.6 -0.89 0
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59923 24902485 1 N3O3C14H21 A3B3C14D21 -118.97 3.32 -9.53 -0.51 0
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59924 24902488 1 N3O3C16H25 A3B3C16D25 -134.73 4.46 -9.37 -0.27 0
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59925 24902491 1 ClNF3O3C18H23 ABC3D3E18F23 -311.1 2.15 -9.43 -0.96 0
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59926 24902492 1 NO3F4C18H23 AB3C4D18E23 -343.6 4.37 -9.51 -0.92 0
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59927 24902496 1 NF3O4C18H24 AB3C4D18E24 -346.87 3.24 -9.37 -0.22 0
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59928 24902497 1 NF3O3C18H24 AB3C3D18E24 -305.77 3.96 -9.42 -0.62 0
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59929 24902498 1 NF3O4C18H24 AB3C4D18E24 -344.51 2.37 -9.32 -0.44 0
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59930 24902510 1 N2O3C16H24 A2B3C16D24 -136.93 2.95 -9.34 -0.14 0
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59931 24902514 1 N2F3O3C17H23 A2B3C3D17E23 -297.81 4.54 -9.56 -0.96 0
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59932 24902516 1 N2O3C17H26 A2B3C17D26 -145.52 3.58 -9.03 -0.11 0
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59933 24902542 1 ClFNO3C17H23 ABCD3E17F23 -199.77 4.2 -9.16 -0.41 0
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59934 24902547 1 N2F3O3C17H23 A2B3C3D17E23 -297.15 3.06 -9.62 -0.92 0
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59935 24902550 1 N2O3C17H26 A2B3C17D26 -141.85 3.21 -8.96 0.09 0
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59936 24902551 1 N3O3C15H23 A3B3C15D23 -122.55 2.06 -9.53 -0.46 0
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59937 24902556 1 ClNF3O3C16H19 ABC3D3E16F19 -300.13 4.21 -9.42 -0.95 1
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59938 26512224 1 SN2O3C18H25 AB2C3D18E25 -56.8 4.06 0.0 0.0 1
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59939 26512226 1 SN2O3C18H25 AB2C3D18E25 -55.46 3.91 0.0 0.0 0
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59940 26512227 1 SN2O3C18H24 AB2C3D18E24 -74.35 5.17 -8.37 -0.15 1
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59941 26512228 1 SN2O5C17H27 AB2C5D17E27 -174.41 8.96 0.0 0.0 0
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59942 26512229 1 SN2O5C17H26 AB2C5D17E26 -193.14 6.45 -8.49 -0.04 1
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59943 26512230 1 SN2O5C17H27 AB2C5D17E27 -176.86 6.42 0.0 0.0 0
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59944 26512231 1 SN2O5C17H26 AB2C5D17E26 -195.94 3.79 -8.08 0.42 1
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59945 26512234 1 N3O4C22H28 A3B4C22D28 -96.93 4.32 0.0 0.0 0
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59946 26512235 1 N3O4C22H27 A3B4C22D27 -112.12 5.24 -8.1 -0.34 1
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59947 26512236 1 N2O4C21H29 A2B4C21D29 -103.09 4.36 0.0 0.0 0
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59948 26512237 1 N2O4C21H28 A2B4C21D28 -120.88 2.78 -8.31 0.15 1
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59949 26512238 1 N2O3C23H33 A2B3C23D33 -75.4 1.04 0.0 0.0 0
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59950 26512239 1 N2O3C23H32 A2B3C23D32 -95.3 5.67 -8.51 0.06 1