D00PEJ -OEChem-10101305022D 39 41 0 0 0 0 0 0 0999 V2000 5.4641 0.4130 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 1.2790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 -0.4530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0870 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 0.8922 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9446 -0.6216 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7932 -2.1315 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6765 -0.6416 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.9130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.9130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.9130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.4130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.9130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.4130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9561 0.3784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9561 2.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 1.9338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.4130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.4130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.9130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8047 -1.1316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.2070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 2.2230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.0330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.7070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9490 3.0676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3979 2.2459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.7230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.1030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.5330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.7230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3265 -2.4477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2527 -2.4353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2098 -0.9578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6837 -0.0216 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 4 1 0 0 0 0 1 9 1 0 0 0 0 4 17 1 0 0 0 0 4 28 1 0 0 0 0 5 15 2 0 0 0 0 5 18 1 0 0 0 0 6 15 1 0 0 0 0 6 24 2 0 0 0 0 7 24 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 24 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 11 14 1 0 0 0 0 11 16 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 16 18 2 0 0 0 0 16 29 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 18 30 1 0 0 0 0 19 21 1 0 0 0 0 19 31 1 0 0 0 0 20 22 2 0 0 0 0 20 32 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 M END $$$$