BA2W5K -OEChem-04012119352D 28 30 0 0 0 0 0 0 0999 V2000 2.9789 -2.1353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9488 1.5435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2954 2.0596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8507 0.7253 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3780 -0.3990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3507 -0.8136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3507 -0.8136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0417 0.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6597 0.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6657 -1.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0263 0.3697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6751 0.3697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0356 -1.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6452 -1.3896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3233 -0.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0562 -1.3896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9731 1.3243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8507 1.3453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8641 -2.1857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8415 0.9616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8372 -2.1857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7174 -0.2677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4692 -1.8520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1266 -1.3242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3931 -1.8046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8734 -2.5381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1335 2.1353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 18 1 0 0 0 0 2 17 1 0 0 0 0 2 28 1 0 0 0 0 3 17 2 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 19 1 0 0 0 0 5 12 2 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 6 10 1 0 0 0 0 7 9 2 0 0 0 0 7 13 1 0 0 0 0 8 11 1 0 0 0 0 9 12 1 0 0 0 0 10 14 2 0 0 0 0 10 20 1 0 0 0 0 11 15 2 0 0 0 0 11 21 1 0 0 0 0 12 17 1 0 0 0 0 13 16 2 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 15 23 1 0 0 0 0 16 24 1 0 0 0 0 18 25 1 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 M END $$$$