BJ9P5M -OEChem-04022104133D 28 30 0 0 0 0 0 0 0999 V2000 1.6657 1.9049 -0.1612 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7152 -2.7676 0.1875 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4018 -1.1483 0.0721 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1803 0.9807 -0.0939 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3916 -0.4165 0.0236 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7671 0.3230 0.0201 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8392 -0.3917 0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8544 0.9376 -0.0833 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8494 -0.5209 0.0844 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4591 -1.8014 0.1751 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0318 -1.7590 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2299 -0.0184 0.0267 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6631 0.1940 -0.0273 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2325 -0.7952 -0.5432 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5381 1.2359 0.5419 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8226 0.5752 -0.0618 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3805 1.8777 -0.1629 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5168 -0.2764 -0.5735 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8536 1.6639 0.4631 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2089 0.2024 -0.0332 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8134 1.2421 -0.3991 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0465 -2.7008 0.2392 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0424 -1.7760 -0.9664 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7922 1.8754 1.0025 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9566 2.7896 -0.2352 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3342 -0.8415 -1.0092 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1464 2.6337 0.8519 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3554 -1.3781 0.0898 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 17 1 0 0 0 0 2 11 2 0 0 0 0 3 20 1 0 0 0 0 3 28 1 0 0 0 0 4 20 2 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 6 9 1 0 0 0 0 6 21 1 0 0 0 0 7 13 2 0 0 0 0 7 16 1 0 0 0 0 8 18 2 0 0 0 0 8 19 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 14 18 1 0 0 0 0 14 23 1 0 0 0 0 15 19 2 0 0 0 0 15 24 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 25 1 0 0 0 0 18 26 1 0 0 0 0 19 27 1 0 0 0 0 M END $$$$