D05NIE -OEChem-10101305022D 46 48 0 0 0 0 0 0 0999 V2000 4.0981 2.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.7990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5981 1.2010 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.2010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.7010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.7010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0981 2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5981 1.2010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5981 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 3.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0981 3.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 0.5933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 1.2836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 1.2836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 0.5933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -0.8816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -0.1914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -0.1914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -0.8816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -2.3816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -1.6914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4781 2.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 2.9330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0155 0.9889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7057 0.5904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2181 2.9330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7881 4.3360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4081 4.3360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.1790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9081 0.6640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9081 1.7379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.9890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.4190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 33 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 2 10 1 0 0 0 0 3 14 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 11 1 0 0 0 0 9 12 2 0 0 0 0 10 13 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 14 1 0 0 0 0 11 15 2 0 0 0 0 12 16 1 0 0 0 0 12 34 1 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 17 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 20 1 0 0 0 0 18 40 1 0 0 0 0 19 21 2 0 0 0 0 19 41 1 0 0 0 0 20 22 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 M END $$$$