BS39UM -OEChem-04012114432D 38 40 0 0 0 0 0 0 0999 V2000 5.2215 3.2342 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -0.2666 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.3817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 1.4547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8366 2.1128 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8817 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3092 1.3502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.1183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6456 0.7115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8970 2.1592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8147 2.3207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8916 2.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4903 3.0727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4793 2.8637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0781 3.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0726 3.7772 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 2.0000 -1.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.3817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1384 0.7542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8665 1.0784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3758 2.5276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.9283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1437 1.4882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8737 3.1375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0960 2.7988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8259 4.4481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.5717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4370 4.2788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.5717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.1917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -3.3448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.1917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -4.4187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 9 2 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 7 1 0 0 0 0 4 9 1 0 0 0 0 4 11 1 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 5 26 1 0 0 0 0 6 20 1 0 0 0 0 6 22 2 0 0 0 0 7 10 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 12 15 1 0 0 0 0 12 27 1 0 0 0 0 13 16 1 0 0 0 0 13 28 1 0 0 0 0 14 17 2 0 0 0 0 14 29 1 0 0 0 0 15 18 1 0 0 0 0 15 20 2 0 0 0 0 16 19 2 0 0 0 0 16 30 1 0 0 0 0 17 19 1 0 0 0 0 17 31 1 0 0 0 0 18 21 2 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 M END $$$$