BY96EM -OEChem-04012114232D 42 44 0 0 0 0 0 0 0999 V2000 2.0000 -3.3170 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -1.9510 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -3.6830 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3241 -0.3170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7404 -1.1217 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.3170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.1830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.3170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7404 0.4877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3241 -0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9331 1.0771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.9370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3241 -0.9370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9441 -0.3170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3241 0.3030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.6270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.4370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -1.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6728 3.0753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2742 3.7656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5062 4.2200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 3.9930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8862 3.1461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 26 1 0 0 0 0 3 26 1 0 0 0 0 4 20 1 0 0 0 0 4 27 1 0 0 0 0 5 19 2 0 0 0 0 6 20 2 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 7 18 1 0 0 0 0 8 13 2 0 0 0 0 9 13 1 0 0 0 0 9 16 2 0 0 0 0 10 14 2 0 0 0 0 10 16 1 0 0 0 0 11 16 1 0 0 0 0 11 19 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 2 0 0 0 0 14 20 1 0 0 0 0 15 29 1 0 0 0 0 17 19 1 0 0 0 0 17 22 2 0 0 0 0 17 23 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 21 24 2 0 0 0 0 21 25 1 0 0 0 0 21 26 1 0 0 0 0 22 24 1 0 0 0 0 22 34 1 0 0 0 0 23 25 2 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 25 37 1 0 0 0 0 27 28 1 0 0 0 0 27 38 1 0 0 0 0 27 39 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 M END $$$$