BB5IK4 -OEChem-04022105052D 65 67 0 0 0 0 0 0 0999 V2000 8.9688 -2.0810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2901 -3.3504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9235 -1.6576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.1684 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.1684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.3316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.3316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 -1.7562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6551 -1.7562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.8316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 -2.7073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 -2.7073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.8316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.3316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2885 -1.5240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6397 -1.5240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6491 -3.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2791 -3.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9915 -2.2927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.3316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6696 -3.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9367 -2.2927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2586 -3.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.8316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6408 -2.8215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9394 -3.8793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2675 -3.1388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6181 -2.6099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9168 -3.6676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6341 -4.8316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -0.2761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 0.4142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 0.4392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -0.2511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 1.2239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 1.9142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 1.9392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 1.2489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 2.7239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 3.4142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 3.4392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 2.7489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4733 -0.9322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4549 -0.9322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4507 -4.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4775 -4.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4766 4.2239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0781 4.9142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0827 -3.7457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3308 -2.1614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8455 -3.7457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 5.3685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 5.1415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 4.2946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1163 -3.1521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8753 -3.3955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3561 -4.3385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7920 -2.8082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0330 -2.5648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0480 -4.2736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5227 -3.5364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7855 -3.0617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0437 -4.6422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4448 -5.4219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2245 -5.0209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 25 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 28 2 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 10 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 11 2 0 0 0 0 8 15 1 0 0 0 0 9 12 1 0 0 0 0 9 16 2 0 0 0 0 10 13 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 18 2 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 20 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 19 2 0 0 0 0 15 43 1 0 0 0 0 16 22 1 0 0 0 0 16 44 1 0 0 0 0 17 21 2 0 0 0 0 17 45 1 0 0 0 0 18 23 1 0 0 0 0 18 46 1 0 0 0 0 19 21 1 0 0 0 0 20 24 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 28 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 26 30 1 0 0 0 0 26 57 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 M END $$$$