BE89JU -OEChem-04022109132D 49 51 0 0 0 0 0 0 0999 V2000 8.5991 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5273 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5273 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5957 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7987 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7206 -1.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1191 -1.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6738 -0.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2753 0.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7987 -2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5957 -2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8637 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0666 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5307 -2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3278 -2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 -2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0643 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0643 0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 17 1 0 0 0 0 2 25 2 0 0 0 0 3 6 1 0 0 0 0 3 49 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 5 17 1 0 0 0 0 5 23 2 0 0 0 0 6 26 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 7 27 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 18 1 0 0 0 0 15 40 1 0 0 0 0 16 19 2 0 0 0 0 16 41 1 0 0 0 0 17 21 2 0 0 0 0 18 20 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 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 24 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 M END $$$$