BJ4L2D -OEChem-04022110282D 41 43 0 1 0 0 0 0 0999 V2000 8.1424 -1.4832 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.7852 1.8211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4315 1.2831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7260 -2.4105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7260 -2.4105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7260 -0.6784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.1784 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 9.7260 -0.6784 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.1784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.3216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.6784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.1784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.1784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.6784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1424 0.1263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7260 -0.6784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4530 1.0768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.3216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2260 -1.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2260 -1.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 0.4042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -0.2861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 0.7965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 0.7965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -2.1534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -2.1534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -2.1534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -2.1534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0360 -0.1415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.1316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.9416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.4884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.1316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9778 2.4105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3460 -2.4105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 16 1 0 0 0 0 2 18 1 0 0 0 0 2 40 1 0 0 0 0 3 18 2 0 0 0 0 4 23 2 0 0 0 0 5 25 1 0 0 0 0 5 41 1 0 0 0 0 6 25 2 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 7 14 1 0 0 0 0 8 16 1 0 0 0 0 8 23 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 12 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 13 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 14 17 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 19 21 1 0 0 0 0 19 35 1 0 0 0 0 20 22 2 0 0 0 0 20 36 1 0 0 0 0 21 24 2 0 0 0 0 21 37 1 0 0 0 0 22 24 1 0 0 0 0 22 38 1 0 0 0 0 23 25 1 0 0 0 0 24 39 1 0 0 0 0 M END $$$$