B5HAI7 -OEChem-04022102562D 29 32 0 0 0 0 0 0 0999 V2000 5.1266 -1.7571 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0777 -0.4481 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1266 -0.1391 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6075 -0.9481 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0239 -1.7528 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6237 1.9639 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5388 -0.9481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5388 -0.9481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0239 -0.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0777 -1.4481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 -1.7571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3346 0.8071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 -0.1391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 -2.7082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6667 1.5514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3131 1.0134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9774 2.5020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9559 2.7082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1426 0.4506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6704 -2.8998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4517 -3.2978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8497 -2.5166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4984 -0.0837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0601 1.4236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7271 0.5519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5633 2.9634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1485 3.2975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 11 1 0 0 0 0 2 12 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 4 9 2 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 11 2 0 0 0 0 7 18 1 0 0 0 0 7 20 2 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 8 14 1 0 0 0 0 10 13 1 0 0 0 0 12 15 1 0 0 0 0 13 17 1 0 0 0 0 13 18 2 0 0 0 0 14 16 2 0 0 0 0 14 21 1 0 0 0 0 15 22 1 0 0 0 0 15 23 1 0 0 0 0 15 24 1 0 0 0 0 16 25 1 0 0 0 0 17 19 2 0 0 0 0 17 26 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 29 1 0 0 0 0 M END $$$$