BAGO65 -OEChem-04012117172D 50 53 0 0 0 0 0 0 0999 V2000 12.4583 -1.7329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -0.7329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 2.2671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 -0.7329 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 -0.2329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 -1.7329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -0.2329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4583 -0.7329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 -2.2329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 0.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -0.2329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 0.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 1.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2342 -0.7676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 1.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3282 -0.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2342 1.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3282 0.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2458 -1.7675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 -0.2604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -0.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7359 -1.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 -2.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0038 -1.7704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9908 0.2420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1938 0.2420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1157 -1.6253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5142 -2.3155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0689 -0.8406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6704 -0.1503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1938 -2.7079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9908 -2.7079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0363 0.7301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2632 1.5771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4163 1.8040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2414 1.9217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7924 1.1000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6258 -1.7747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2530 -2.3875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8658 -1.7604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9928 0.2161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1958 0.2130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8617 0.3529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 -2.0717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 -0.4625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8742 -2.8871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4681 -2.0825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 8 1 0 0 0 0 2 12 1 0 0 0 0 3 17 1 0 0 0 0 3 21 1 0 0 0 0 4 14 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 6 9 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 10 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 11 2 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 14 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 15 17 2 0 0 0 0 15 20 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 19 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 23 46 1 0 0 0 0 24 26 2 0 0 0 0 24 47 1 0 0 0 0 25 27 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 M END $$$$