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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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380395 134970835 2 ON3H6C7 AB3C6D7 116.88 2.93 -9.89 -0.85 0
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380396 134970836 1 O2N3C17H22 A2B3C17D22 -11.37 4.08 0.0 0.0 0
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380397 134970837 1 N3O3C11H19 A3B3C11D19 -105.06 3.5 -9.2 0.3 1
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380398 134970839 1 PO2C19H34 AB2C19D34 -124.05 3.73 0.0 0.0 0
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380399 134970840 1 OPH23C34 ABC23D34 101.01 1.63 -8.21 -1.07 0
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380400 134970842 1 INO2C24H24 ABC2D24E24 9.53 5.15 -8.29 -0.49 0
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380401 134970843 1 NO2H29C30 AB2C29D30 22.63 2.32 -8.17 0.15 0
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380402 134970846 2 NO2C11H17 AB2C11D17 -149.39 1.94 -8.64 0.47 0
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380403 134970847 1 SiO4C12H26 AB4C12D26 -260.79 2.22 -9.03 1.01 0
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380404 134970848 1 LiO4C16H21 AB4C16D21 -130.31 7.04 -7.6 0.74 0
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380405 134970849 2 O2C8H11 A2B8C11 -165.93 1.45 -9.38 0.18 1
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380406 134970850 1 ClNOC6H11 ABCD6E11 -19.86 3.4 0.0 0.0 0
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380407 134970851 1 SeN2O2C18H24 AB2C2D18E24 -63.37 2.37 -8.78 -0.74 0
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380408 134970852 1 O5C6H12 A5B6C12 -224.11 1.94 -10.34 1.13 0
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380409 134970853 1 NO7C17H21 AB7C17D21 -268.39 4.28 -10.1 -1.45 0
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380410 134970854 2 NO4C10H13 AB4C10D13 -318.48 6.86 -9.72 -1.37 0
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380411 134970855 1 O5C17H20 A5B17C20 -191.43 2.14 -8.76 -0.19 0
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380412 134970856 1 O5C15H16 A5B15C16 -187.04 6.29 -8.99 -0.45 0
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380413 134970857 1 O5C16H18 A5B16C18 -184.73 3.08 -8.82 -0.27 0
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380414 134970859 2 NOPH20C21 ABCD20E21 78.84 6.11 -8.01 -0.56 -1
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380415 134970860 1 N2Rh2O4C14H17 A2B2C4D14E17 -84.04 20.33 0.0 0.0 0
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380416 134970861 1 N2O2C21H30 A2B2C21D30 -73.62 1.53 -9.39 -0.51 0
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380417 134970862 2 ClNRbH2C6 ABCD2E6 -22.23 11.94 -7.18 -0.9 0
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380418 134970863 2 ORbN2H7C10 ABC2D7E10 -10.01 18.3 -6.01 -0.17 0
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380419 134970864 2 ON2H8C10 AB2C8D10 61.83 4.19 -8.39 -1.16 2
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380420 134970865 1 FCl2N2C7H13 AB2C2D7E13 31.9 21.52 -6.09 -2.31 0
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380421 134970866 1 NO4H19C21 AB4C19D21 -93.64 2.76 -8.43 -1.78 0
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380422 134970867 1 NO4H19C21 AB4C19D21 -91.49 1.48 -8.43 -1.62 0
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380423 134970868 1 O5C16H16 A5B16C16 -160.04 1.02 -9.75 -1.71 0
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380424 134970869 1 O5C16H16 A5B16C16 -159.24 1.55 -9.75 -1.69 0
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380425 134970870 1 O5C17H18 A5B17C18 -166.84 1.55 -9.71 -1.66 0
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380426 134970872 1 O5H18C21 A5B18C21 -127.57 1.34 -9.01 -1.76 0
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380427 134970873 1 SO4C17H18 AB4C17D18 -129.08 0.75 -8.67 -1.65 0
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380428 134970874 1 SO4C17H18 AB4C17D18 -130.19 1.38 -8.83 -1.67 0
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380429 134970875 1 SO4H18C21 AB4C18D21 -93.41 2.58 -8.98 -1.71 0
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380430 134970876 1 NO4C19H21 AB4C19D21 -117.66 2.64 -9.03 -1.72 0
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380431 134970877 1 NO4C19H21 AB4C19D21 -123.8 2.64 -9.01 -1.69 0
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380432 134970879 1 O5C17H18 A5B17C18 -135.61 2.59 -9.77 -1.9 0
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380433 134970880 1 O6C19H24 A6B19C24 -227.62 4.01 -9.96 -1.76 0
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380434 134970881 1 SiO3C18H30 AB3C18D30 -167.35 3.7 -8.97 -0.2 0
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380435 134970883 1 LiPO3H18C20 ABC3D18E20 -69.88 1.6 -7.7 0.21 0
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380436 134970884 1 OLi2N2C22H22 AB2C2D22E22 100.05 10.34 -6.45 -0.87 0
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380437 134970885 1 ON2C22H24 AB2C22D24 17.01 2.36 -8.41 -1.11 0
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380438 134970886 1 LiO2H17C24 AB2C17D24 8.91 7.65 -7.74 -0.43 0
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380439 134970887 1 NO6C15H29 AB6C15D29 -286.2 7.52 -9.76 0.4 0
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380440 134970888 1 BO4C31H31 AB4C31D31 -121.75 1.92 -9.35 0.12 0
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380441 134970891 1 NO3C17H17 AB3C17D17 -42.38 4.43 -9.85 -0.38 0
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380442 134970892 1 O5C16H18 A5B16C18 -186.67 2.06 -8.7 -0.15 0
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380443 134970894 1 SO2C14H20 AB2C14D20 -84.45 2.61 -8.71 -0.06 0
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380444 134970895 1 BrO4C17H23 AB4C17D23 -180.41 4.26 -9.4 -0.08 3
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380445 134970896 1 N6O18C79H91 A6B18C79D91 -327.86 43.16 0.0 0.0 0
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380446 134970897 1 N6O18C79H88 A6B18C79D88 -383.5 9.02 -8.01 -0.95 1
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380447 134970898 1 NOCl2H4C7 ABC2D4E7 40.42 3.05 0.0 0.0 1
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380448 134970899 1 Cl4N4H27C44 A4B4C27D44 372.21 5.06 0.0 0.0 0
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380449 134970900 1 NSO4C13H15 ABC4D13E15 -38.26 9.71 -10.45 -1.26 0
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380450 134970901 1 SN2O3C8H10 AB2C3D8E10 -83.1 5.43 -9.53 -0.8 0
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380451 134970902 1 NO3C8H9 AB3C8D9 -92.28 7.83 -9.84 -0.72 0
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380452 134970903 1 NOC9H15 ABC9D15 0.29 4.34 -8.65 0.51 -1
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380453 134970904 1 NOC21H22 ABC21D22 54.39 1.32 0.0 0.0 0
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380454 134970905 1 NOC21H23 ABC21D23 37.36 1.56 -9.02 0.0 -1
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380455 134970906 1 NOC21H22 ABC21D22 52.39 2.67 0.0 0.0 0
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380456 134970907 1 NOC21H23 ABC21D23 35.95 2.62 -9.22 0.15 0
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380457 134970908 1 SO2N3C15H20 AB2C3D15E20 -7.86 3.87 0.0 0.0 0
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380458 134970909 1 NO6C17H19 AB6C17D19 -206.48 6.36 -9.5 -1.57 0
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380459 134970910 1 ClNO5C20H20 ABC5D20E20 -131.44 5.28 -9.73 -0.48 0
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380460 134970911 1 ClNO3H16C17 ABC3D16E17 -52.0 5.46 -9.88 -0.64 0
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380461 134970913 1 NO3H15C16 AB3C15D16 -31.33 3.32 -9.61 -0.66 0
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380462 134970914 1 NO4C20H21 AB4C20D21 -77.43 6.36 -9.25 -0.55 0
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380463 134970915 1 NO3C17H17 AB3C17D17 -42.03 3.5 -9.3 -0.49 0
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380464 134970918 1 FNO4H18C19 ABC4D18E19 -116.36 2.36 -9.83 -0.63 0
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380465 134970919 1 FNO3H14C16 ABC3D14E16 -78.14 3.37 -9.92 -0.73 0
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380466 134970920 1 NCl2O4H17C19 AB2C4D17E19 -86.24 5.12 -9.76 -0.99 0
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380467 134970923 1 NO4C19H23 AB4C19D23 -162.96 4.34 -9.06 0.02 0
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380468 134970924 1 NO7C18H23 AB7C18D23 -267.91 4.22 -9.88 -1.35 0
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380469 134970926 1 F3O4C17H17 A3B4C17D17 -299.8 2.35 -10.44 -0.9 0
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380470 134970928 1 ISiO2C19H25 ABC2D19E25 -95.35 2.53 -9.17 -1.02 0
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380471 134970929 1 O3C13H22 A3B13C22 -122.69 1.98 -9.65 0.96 0
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380472 134970930 1 O5C20H28 A5B20C28 -214.23 4.76 -9.53 0.22 0
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380473 134970931 1 N2O5C20H28 A2B5C20D28 -186.56 4.85 -9.8 -0.66 0
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380474 134970934 1 NBr2O6C18H21 AB2C6D18E21 -228.9 5.27 -9.88 -1.75 0
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380475 134970935 2 O3C16H22 A3B16C22 -213.13 1.95 -8.12 -0.15 4
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380476 134970936 1 N5O6C46H51 A5B6C46D51 -59.06 9.0 -6.61 -0.71 0
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380477 134970938 1 NO4C13H17 AB4C13D17 -100.07 4.97 -9.59 -0.63 1
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380479 134970940 1 NO2C11H14 AB2C11D14 -7.88 2.65 0.0 0.0 0
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380480 134970941 1 NO2C11H15 AB2C11D15 -26.54 2.58 -9.3 0.35 0
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380481 134970942 1 OC23H24 AB23C24 15.96 2.36 -8.22 -0.93 0
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380482 134970943 1 O2F3H13C14 A2B3C13D14 -218.44 4.89 -10.39 -0.81 0
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380483 134970944 1 ClO4C16H17 AB4C16D17 -146.96 2.32 -9.72 -0.57 0
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380484 134970945 1 FO4C16H17 AB4C16D17 -184.89 2.37 -9.92 -0.51 0
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380485 134970946 1 IOH15C16 ABC15D16 12.27 3.07 -9.26 -1.17 1
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380486 134970947 1 IO2Si2C22H34 AB2C2D22E34 -140.64 0.67 0.0 0.0 0
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380487 134970948 1 ClNO4C8H12 ABC4D8E12 -98.2 3.98 -10.66 -0.97 0
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380488 134970949 1 NSO3C16H17 ABC3D16E17 -66.77 5.25 -8.16 -0.77 0
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380489 134970950 1 NC10H15 AB10C15 1.86 3.31 -8.28 1.48 0
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380490 134970951 1 NO4C11H19 AB4C11D19 -156.09 3.15 -9.5 0.25 0
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380491 134970952 1 Cl2N4O5C15H16 A2B4C5D15E16 -166.97 4.89 -9.8 -1.36 0
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380492 134970953 1 N4O6C15H18 A4B6C15D18 -203.65 11.81 -9.09 -0.27 0
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380493 134970954 1 ClO3N5C11H14 AB3C5D11E14 -81.96 3.02 -9.32 -0.87 0
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380494 134970956 2 O2C13H16 A2B13C16 -133.18 1.89 -8.4 -0.45 0
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380495 134970957 1 N4O4C21H36 A4B4C21D36 -162.87 0.65 -9.07 0.29 0