BKJR95 -OEChem-04012116352D 38 40 0 0 0 0 0 0 0999 V2000 6.7210 -0.2618 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 1.9934 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.6715 0.0488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7705 -0.5725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.4934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3600 2.8594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3600 1.1274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 0.6887 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7260 2.4934 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.9934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 1.4934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.9934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 2.2981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.4934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0316 -1.2124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.4934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.9934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3638 -1.9567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0102 -1.4186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6745 -2.9072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3208 -2.3691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6530 -3.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6029 2.8875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.1134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 2.3034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7571 -1.8288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4242 -0.9571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7260 3.1134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2629 2.1834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2604 -3.3687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9275 -2.4970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8456 -3.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 1.5303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.3034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.4565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 8 1 0 0 0 0 1 15 1 0 0 0 0 2 6 2 0 0 0 0 2 7 2 0 0 0 0 2 9 1 0 0 0 0 2 11 1 0 0 0 0 5 17 1 0 0 0 0 5 24 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 12 2 0 0 0 0 10 14 1 0 0 0 0 11 13 2 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 25 1 0 0 0 0 14 17 2 0 0 0 0 14 26 1 0 0 0 0 15 19 2 0 0 0 0 15 20 1 0 0 0 0 16 18 2 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 18 28 1 0 0 0 0 19 21 1 0 0 0 0 19 29 1 0 0 0 0 20 22 2 0 0 0 0 20 30 1 0 0 0 0 21 23 2 0 0 0 0 21 33 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 M END $$$$