B8DS9E -OEChem-04022105183D 33 35 0 1 0 0 0 0 0999 V2000 -0.2155 2.5467 -1.2104 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1076 -0.1553 0.3453 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 -1.3309 1.1515 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2989 0.9579 0.9923 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7231 3.2287 1.2519 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6559 -0.2250 -1.1542 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0475 -0.2511 0.2291 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1908 -0.2652 -1.0146 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5505 -1.4190 1.0601 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6127 -1.4332 -0.1224 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1808 0.9383 -2.0207 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5678 -0.4807 0.1377 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1175 -1.4294 0.1092 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4157 2.1357 0.4852 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1631 -1.6354 -0.4475 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5114 0.4056 0.6087 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5391 -1.5877 -0.4013 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3825 -1.1415 -1.6981 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5596 0.6734 -0.5851 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6524 -0.3663 -2.0043 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2941 -2.4013 0.6444 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1624 -1.3981 2.0861 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3323 -2.3880 -0.5849 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8522 0.7619 -2.3405 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7778 1.0005 -2.9371 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4348 -0.5135 0.6199 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4052 -2.2649 0.7567 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6657 -1.5143 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6213 -2.4633 -0.8865 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3618 1.3569 1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2375 -2.3250 -0.7711 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 3.1453 2.2521 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8136 4.1516 0.8413 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 14 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 4 7 1 0 0 0 0 4 14 2 0 0 0 0 5 14 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 6 18 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 13 1 0 0 0 0 10 23 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 15 1 0 0 0 0 12 16 2 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 15 17 2 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 M END $$$$