BUI13D -OEChem-04012114432D 43 45 0 0 0 0 0 0 0999 V2000 6.9535 3.2342 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5856 -0.2666 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.3817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.3817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 1.4547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5686 2.1128 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0413 1.3502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.1183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3776 0.7115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5468 2.3207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6291 2.1592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.3817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6236 2.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2224 3.0727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.3817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2114 2.8637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8101 3.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8047 3.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8704 0.7542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5986 1.0784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1079 2.5276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 0.9283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8758 1.4882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6057 3.1375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.5717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.5717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.1917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8280 2.7988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5580 4.4481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1691 4.2788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.3448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.5717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.4187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 -4.4187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -4.1917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 -3.3448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 9 2 0 0 0 0 3 18 1 0 0 0 0 3 24 1 0 0 0 0 4 19 1 0 0 0 0 4 25 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 6 28 1 0 0 0 0 7 11 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 21 1 0 0 0 0 14 30 1 0 0 0 0 15 22 2 0 0 0 0 15 31 1 0 0 0 0 16 18 1 0 0 0 0 16 32 1 0 0 0 0 17 20 2 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 34 1 0 0 0 0 21 23 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END $$$$