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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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297833 117633319 1 NF2S2O4C7H13 AB2C2D4E7F13 -261.5 1.95 -8.77 -1.01 0
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297834 117633320 1 NF2S2O5C8H13 AB2C2D5E8F13 -306.93 5.8 -8.73 -0.81 0
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297835 117633321 1 PN7O9C29H48 AB7C9D29E48 -384.95 4.91 -8.9 -1.12 0
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297836 117633365 1 P3N6O13C20H35 A3B6C13D20E35 -755.42 10.45 -8.4 -0.63 0
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297837 117633390 1 F3P3N7O10C22H37 A3B3C7D10E22F37 -672.91 8.72 -9.18 -0.27 0
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297838 117633400 3 O2C9H12 A2B9C12 -251.03 5.47 -9.41 -0.54 0
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297839 117633431 1 NO5C11H17 AB5C11D17 -228.84 4.68 -10.07 -0.14 0
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297840 117633455 1 IN2C4H9 AB2C4D9 36.79 2.06 -8.55 -0.81 0
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297841 117633532 1 N3C39H43 A3B39C43 83.73 0.91 -9.24 -0.98 0
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297842 117633564 1 ClSN2O3C22H25 ABC2D3E22F25 -68.57 2.9 -8.25 -0.58 0
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297843 117633568 1 ClN2O4C23H27 AB2C4D23E27 -95.18 2.99 -8.59 -0.46 0
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297844 117633595 1 N2O3C20H22 A2B3C20D22 -82.0 5.19 -8.39 -0.77 0
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297845 117633749 1 ClOSN5H18C19 ABCD5E18F19 55.7 8.01 -8.7 -1.06 0
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297846 117633760 1 HSCl2N2F3C7 ABC2D2E3F7 -100.88 4.41 -9.84 -1.96 0
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297847 117633769 1 OSCl2N3H7C14 ABC2D3E7F14 54.53 3.99 -9.09 -1.65 0
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297848 117633776 1 O25C31H56 A25B31C56 -1130.77 11.1 -10.06 0.09 0
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297849 117633779 1 SO3N4H20C21 AB3C4D20E21 -19.57 4.79 -9.05 -1.35 0
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297851 117633842 1 FSN3O4H34C37 ABC3D4E34F37 -48.93 2.33 -9.23 -1.23 -1
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297852 117633874 1 SN2O4F6H33C38 AB2C4D6E33F38 -303.55 5.94 0.0 0.0 0
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297854 117633912 1 ON2S2C20H20 AB2C2D20E20 32.6 4.8 -8.02 -0.94 0
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297855 117634006 1 FNO4C39H54 ABC4D39E54 -265.46 5.33 -9.2 0.0 0
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297856 117634033 1 NO4C35H69 AB4C35D69 -302.15 4.55 -9.57 0.36 0
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297857 117634079 1 N5O5C18H23 A5B5C18D23 -70.73 1.24 -8.81 -1.2 0
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297858 117634087 1 S3N7O7C29H39 A3B7C7D29E39 -206.62 6.91 -9.11 -1.94 0
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297859 117634092 2 NOC7H7 ABC7D7 -6.06 5.84 -8.51 -1.16 0
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297860 117634250 1 SN3H35C53 AB3C35D53 230.79 2.4 -7.62 -1.19 0
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297861 117634279 1 ON9C30H35 AB9C30D35 119.97 5.54 -8.37 -1.02 0
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297862 117634663 1 SO12C13H20 AB12C13D20 -498.95 6.41 -10.44 -1.39 0
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297863 117634709 1 O6C11H18 A6B11C18 -282.97 4.8 -10.06 0.82 0
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297864 117634768 1 PN8O9C22H31 AB8C9D22E31 -374.13 12.8 -9.09 -0.65 0
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297865 117634949 1 N6O7C24H34 A6B7C24D34 -233.6 5.21 -8.92 -0.74 0
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297866 117635143 1 NO4C16H23 AB4C16D23 -160.87 3.16 -8.9 0.05 1
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297867 117635387 1 PO5C14H28 AB5C14D28 -253.03 9.35 0.0 0.0 0
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297868 117635579 1 OC15H22 AB15C22 -49.38 1.43 -9.33 0.38 0
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297869 117635613 1 ISN4O6C27H39 ABC4D6E27F39 -209.78 5.99 -8.73 -2.36 0
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297870 117635634 1 ClSO2N4C16H23 ABC2D4E16F23 -32.02 5.32 -9.06 -0.74 0
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297871 117635659 1 F4N4O4H30C33 A4B4C4D30E33 -247.98 6.91 -9.26 -1.29 0
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297872 117635686 1 P3N9O15C30H43 A3B9C15D30E43 -514.33 17.06 0.0 0.0 0
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297873 117635704 1 NO2C12H23 AB2C12D23 -119.7 3.27 -8.66 2.03 0
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297874 117635718 1 PSO4C11H21 ABC4D11E21 -197.15 1.8 -8.87 -1.09 0
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297875 117635883 2 NO2C11H14 AB2C11D14 -155.07 3.93 -9.38 -0.04 0
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297877 117636097 1 BrClON2F8H8C16 ABCD2E8F8G16 -404.75 6.3 -9.17 -1.27 0
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297878 117636142 1 O3N5C24H29 A3B5C24D29 -28.2 2.56 -9.08 -0.69 0
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297879 117636301 1 ClN2C21H45 AB2C21D45 -9.91 53.73 -5.16 -2.13 0
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297880 117636343 1 F3N4O4H15C19 A3B4C4D15E19 -232.67 1.63 -9.57 -1.26 0
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297881 117636358 1 SO5C20H24 AB5C20D24 -210.07 4.35 -8.91 -0.35 0
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297882 117636363 1 SO5C17H18 AB5C17D18 -195.29 6.16 -8.71 -0.5 0
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297883 117636366 1 O2H5C6F9 A2B5C6D9 -557.97 3.4 -11.45 -0.42 0
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297884 117636367 1 NO2S2C16H17 AB2C2D16E17 -41.46 3.57 -9.55 -1.78 0
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297885 117636368 1 SO2F3N3C15H16 AB2C3D3E15F16 -181.4 10.08 -9.22 -1.23 0