BMCA_skeleton.mol Ketcher 12202315422D 46 49 0 0 0 0 0 0 0 0999 V2000 10.9881 8.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9826 10.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1419 9.8560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1315 8.8182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8516 9.8207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8481 8.8274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5677 8.8212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5710 9.8148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7130 10.3176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9853 9.3002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8901 10.8785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7164 11.2873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5580 11.7689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7143 12.2576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3959 11.2813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2374 11.7631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8470 7.8622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2769 8.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2769 7.3383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1315 6.8461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9881 7.3383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4278 8.8164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5788 8.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5788 7.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4278 6.8556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2769 9.3066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7296 6.8556 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8371 6.8480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2374 12.7435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0864 11.2728 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2769 6.3578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5162 10.7161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9972 11.7376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1315 7.7963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9521 11.7725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8178 11.2728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8178 10.2732 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6834 11.7725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1315 5.8465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9596 12.3622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4611 12.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4611 13.3637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0611 13.7637 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.0611 14.4637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5611 14.9637 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.4111 14.9637 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 1 6 1 0 5 2 1 0 2 3 1 0 3 4 1 0 5 6 1 0 7 8 1 0 8 9 1 0 9 5 1 0 6 7 1 0 1 10 1 1 5 11 1 1 9 12 1 0 12 13 1 0 12 14 1 1 13 15 1 0 15 16 1 0 6 17 1 6 4 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 1 1 0 18 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 19 1 0 18 26 1 1 24 27 1 6 21 28 1 1 16 29 2 0 16 30 1 0 19 31 1 1 9 32 1 6 12 33 1 6 4 34 1 6 30 35 1 0 35 36 1 1 36 37 2 0 36 38 1 0 20 39 1 1 35 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 44 46 2 0 M END