LGEM79 -OEChem-05022321493D 27 27 0 0 0 0 0 0 0999 V2000 2.1554 0.9715 -0.9582 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4781 -0.3716 -0.0789 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6412 -0.6211 0.6575 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6169 0.1753 -0.8488 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -0.8961 -1.1438 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2368 1.3857 -0.1424 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4725 -1.2863 0.0987 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0379 0.9917 1.0986 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0885 -0.0669 0.7776 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7912 0.0759 -0.1975 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0587 -0.3582 0.7373 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2012 0.5166 -1.8051 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1986 -1.7904 -1.5666 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3655 -0.5138 -1.9038 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9057 1.9020 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4601 2.1059 0.1413 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8289 -1.8168 0.8102 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2672 -1.9858 -0.1854 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5271 1.8794 1.5156 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3593 0.6116 1.8719 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8536 0.3669 0.1219 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5959 -0.3746 1.6989 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2754 -1.0663 0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2444 -1.3168 1.2814 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5690 -1.2879 0.9995 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2263 0.3865 1.5193 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4354 0.0198 -0.2165 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 2 23 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 8 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 M END $$$$