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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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441732 135242167 1 ClON9H30C31 ABC9D30E31 146.51 6.76 -8.54 -1.18 0
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441733 135242201 1 Cl2N3O4C28H35 A2B3C4D28E35 -179.75 4.51 -8.78 -0.52 0
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441734 135242310 1 SO3N5C19H25 AB3C5D19E25 -40.13 6.05 -8.52 -0.03 0
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441735 135242482 1 ON3C23H29 AB3C23D29 16.71 2.26 -7.69 -0.59 0
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441736 135242495 1 ON4H38C44 AB4C38D44 105.75 5.22 -8.13 -0.75 0
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441737 135242774 1 NSH35C39 ABC35D39 129.62 3.23 -8.04 -0.96 0
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441738 135242794 2 NSH28C31 ABC28D31 175.51 2.16 -7.99 -0.92 0
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441739 135242889 1 OS7H28C50 AB7C28D50 246.96 0.93 -8.37 -1.4 0
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441740 135242988 1 N3O4C15H21 A3B4C15D21 -83.66 1.98 -9.4 -0.1 0
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441741 135243007 1 INOC4H6 ABCD4E6 -4.11 4.96 -9.78 -1.28 0
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441742 135243066 1 O2N3C10H17 A2B3C10D17 -58.44 4.42 -8.91 -0.19 0
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441743 135243077 1 ClNOF4H12C16 ABCD4E12F16 -204.5 2.46 -9.71 -1.1 0
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441744 135243089 1 OC12H14 AB12C14 34.0 2.77 -9.0 -0.81 0
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441745 135243150 2 NC6H10 AB6C10 -3.95 0.2 -9.56 -0.29 0
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441746 135243235 1 FPO6N8C36H50 ABC6D8E36F50 -282.83 9.34 -9.14 -1.19 0
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441747 135243238 1 SC20H24 AB20C24 22.69 2.44 -8.64 -0.1 0
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441748 135243240 1 PO4C22H29 AB4C22D29 -161.12 1.7 -8.32 -0.03 0
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441749 135243260 1 INOC7H14 ABCD7E14 -41.32 2.56 -8.86 -0.85 0
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441750 135243313 1 NO2C9H19 AB2C9D19 -117.37 2.9 -9.04 0.12 0
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441751 135243334 1 NO5C29H35 AB5C29D35 -190.66 4.69 -8.51 -0.85 0
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441752 135243354 1 N3C12H23 A3B12C23 1.99 4.79 -8.89 1.15 0
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441753 135243361 2 N3C14H23 A3B14C23 26.12 4.86 -8.56 -0.1 0
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441754 135243430 2 O3H10C12 A3B10C12 -97.15 7.73 -8.94 -1.62 0
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441755 135243431 1 NS3H35C39 AB3C35D39 94.4 2.42 -8.12 -1.03 0
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441756 135243471 1 OSN2H10C24 ABC2D10E24 130.87 0.96 -8.88 -1.79 0
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441757 135243472 1 FN3O5C21H24 AB3C5D21E24 -197.58 6.56 -9.0 -0.34 0
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441758 135243480 2 O8C16H23 A8B16C23 -682.6 3.11 -8.68 -0.1 0
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441759 135243544 1 ON2C10H18 AB2C10D18 -6.92 4.73 -8.97 1.16 0
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441760 135243585 2 NC7H10 AB7C10 23.63 1.31 -8.2 0.36 0
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441761 135243586 1 N6H8F14C45 A6B8C14D45 -247.68 2.26 -9.86 -2.82 0
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441762 135243634 4 OC6H9 AB6C9 -205.0 3.19 -9.69 -0.67 0
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441763 135243669 1 SO3N5C17H21 AB3C5D17E21 -51.06 2.84 -9.07 -1.22 0
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441764 135243718 1 ClFSN4O6C27H28 ABCD4E6F27G28 -213.14 2.67 -9.28 -1.37 0
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441765 135243867 2 NC3H5 AB3C5 22.47 1.08 -7.55 0.82 0
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441766 135243928 1 NH23C37 AB23C37 315.56 4.0 -7.86 -0.86 0
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441767 135243986 1 NC13H17 AB13C17 35.19 2.02 -8.8 0.16 0
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441768 135243999 1 NH27C43 AB27C43 186.47 3.17 -8.02 -0.67 0
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441769 135244042 2 NC13H15 AB13C15 55.17 2.07 -8.13 0.1 0
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441770 135244166 1 O2N3C32H41 A2B3C32D41 -30.56 7.59 -8.56 0.08 0
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441771 135244249 1 N3O3C30H41 A3B3C30D41 -109.74 5.12 -8.79 -0.17 0
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441772 135244254 1 ON5C28H39 AB5C28D39 3.66 3.35 -8.29 -0.1 0
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441773 135244255 1 NC20H33 AB20C33 -17.86 1.25 -8.35 0.65 0
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441774 135244256 1 N3O4C36H49 A3B4C36D49 -176.06 4.94 -8.71 0.01 0
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441775 135244271 1 ClFNC7H7 ABCD7E7 -37.21 3.35 -9.68 -0.56 0
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441776 135244343 1 ClC11H19 AB11C19 -22.27 3.03 -9.91 0.26 0
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441777 135244355 1 SF6O9C24H28 AB6C9D24E28 -640.42 20.06 -7.98 -2.72 0
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441778 135244373 2 NC21H21 AB21C21 140.93 2.45 -7.98 -1.07 0
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441779 135244453 1 FO4N7C26H26 AB4C7D26E26 5.06 3.84 -9.47 -1.34 0
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441780 135244460 1 NO2C23H35 AB2C23D35 -89.77 1.7 -8.35 -0.95 0
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441781 135244468 1 PN2C15H23 AB2C15D23 18.5 3.26 -8.83 0.17 0
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441782 135244502 1 SCl2F2N2O4H16C18 AB2C2D2E4F16G18 -207.1 4.65 -8.89 -1.15 0
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441783 135244512 1 O5C33H44 A5B33C44 -162.76 6.2 -8.98 -1.75 0
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441784 135244531 1 Cl2N2O2C19H22 A2B2C2D19E22 -35.28 3.61 -9.02 -0.88 0
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441785 135244569 1 ClFO2N5C20H23 ABC2D5E20F23 -82.33 3.49 -9.18 -1.13 0
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441786 135244574 1 FON7C21H26 ABC7D21E26 -27.18 6.59 -8.68 -0.65 0
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441787 135244650 1 ClFO2N5H11C14 ABC2D5E11F14 -46.68 5.2 -9.05 -1.05 0
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441788 135244655 1 ClO3C6H9 AB3C6D9 -72.54 3.1 -10.71 0.31 0
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441789 135244675 1 ON8C22H24 AB8C22D24 64.09 2.54 -8.98 -0.76 0
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441790 135244711 1 NO3C17H27 AB3C17D27 -134.06 3.59 -8.1 0.15 0
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441791 135244737 2 NC28H28 AB28C28 172.45 1.89 -7.63 -0.34 0
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441792 135244762 1 N2C63H70 A2B63C70 135.05 1.99 -7.68 -0.36 0
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441793 135244778 1 N2C61H64 A2B61C64 182.0 1.78 -7.61 -0.31 0
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441794 135244840 2 NH20C23 AB20C23 194.65 0.95 -7.75 -0.54 0
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441795 135244857 1 Cl2N3O5C23H27 A2B3C5D23E27 -213.65 3.45 -8.76 -0.33 1
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441796 135244860 1 PSCl2N2O4C24H24 ABC2D2E4F24G24 -120.19 7.04 0.0 0.0 0
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441797 135244867 2 ClNC9H10 ABC9D10 14.25 1.5 -8.29 -0.36 0
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441798 135244868 1 SCl2N3O4C22H25 AB2C3D4E22F25 -117.25 6.25 -8.93 -0.61 0
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441799 135244903 1 INC33H50 ABC33D50 54.59 2.51 -8.82 -0.55 0
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441800 135244922 1 Cl2N4O6C27H28 A2B4C6D27E28 -207.37 5.47 -8.44 -1.44 0
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441801 135244936 1 S2F4N8O8H42C43 A2B4C8D8E42F43 -304.41 12.38 -8.89 -0.93 0
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441802 135245001 1 N2O3C18H22 A2B3C18D22 -23.26 7.9 -9.12 -1.24 0
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441803 135245003 1 S2Cl3O3N4C39H45 A2B3C3D4E39F45 -44.26 5.11 -8.32 -0.49 0
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441804 135245031 1 SF2N4O15C39H58 AB2C4D15E39F58 -681.68 4.07 -8.99 -1.1 0
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441805 135245044 1 N4O4H20C25 A4B4C20D25 -11.9 6.14 -9.29 -0.96 0
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441806 135245052 1 ClO4C12H13 AB4C12D13 -159.18 5.86 -8.7 -0.52 0