B5BM2F -OEChem-04022106352D 48 52 0 1 0 0 0 0 0999 V2000 6.3981 -1.5346 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8981 -2.4007 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8981 -0.6686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.4654 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.6660 0.4654 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.5346 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -0.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.4654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 0.4654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 1.9654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 1.4654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2480 3.0069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0401 1.9722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1461 3.5346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0482 3.0138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -1.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -2.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -1.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -3.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -1.5346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -3.5346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -2.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -3.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8656 -0.5096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6626 -0.5096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1860 2.0480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7875 1.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3422 -0.1172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7407 0.5730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7076 3.3106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5734 1.6560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1437 4.1546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5863 3.3217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -2.1892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7272 -3.3446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.9146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.2983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -1.3675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -4.1546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5331 -1.7246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5331 -3.3446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 13 1 0 0 0 0 1 20 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 12 1 0 0 0 0 5 12 2 0 0 0 0 5 18 1 0 0 0 0 6 13 2 0 0 0 0 6 19 1 0 0 0 0 7 9 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 11 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 15 2 0 0 0 0 12 13 1 0 0 0 0 14 16 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 19 1 0 0 0 0 18 21 2 0 0 0 0 19 22 2 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 21 25 1 0 0 0 0 21 40 1 0 0 0 0 22 26 1 0 0 0 0 22 41 1 0 0 0 0 23 27 1 0 0 0 0 23 42 1 0 0 0 0 24 28 2 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 27 29 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 M END $$$$