BD3KZ1 -OEChem-04022109083D 33 36 0 0 0 0 0 0 0999 V2000 -0.8291 1.0163 1.3773 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2589 -2.8276 -0.0466 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6436 -0.5209 -1.1549 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6995 -0.7899 -2.1440 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.6789 -0.6331 -0.1857 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6619 -0.5412 -0.9147 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4730 0.1514 0.1021 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3799 0.9570 0.4128 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5126 -1.2018 0.3757 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6147 0.6340 -0.5068 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2884 0.3137 1.0342 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8099 -1.7093 -0.0894 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5386 -0.4955 -0.6728 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4553 -1.8456 0.9825 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4937 2.3211 0.0694 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7422 1.9633 -0.8489 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3337 -1.0710 1.3122 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6639 2.8100 -0.5535 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0292 0.6293 0.8081 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0759 0.3543 -0.5473 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1539 0.5274 1.6079 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4301 -0.1439 -0.3305 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2861 -0.0353 -1.1212 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 0.1375 1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -2.9066 1.2019 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6818 3.0131 0.2797 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6357 2.3477 -1.3269 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5065 -1.5589 1.8021 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7277 3.8651 -0.8086 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2044 0.4493 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1034 0.7458 2.6703 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3012 -0.2426 -2.1882 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2345 0.0635 1.6809 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 19 1 0 0 0 0 2 12 2 0 0 0 0 3 13 2 0 0 0 0 4 6 1 0 0 0 0 5 6 2 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 8 11 2 0 0 0 0 8 15 1 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 10 13 1 0 0 0 0 10 16 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 14 17 2 0 0 0 0 14 25 1 0 0 0 0 15 18 2 0 0 0 0 15 26 1 0 0 0 0 16 18 1 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 23 1 0 0 0 0 20 30 1 0 0 0 0 21 24 2 0 0 0 0 21 31 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 32 1 0 0 0 0 24 33 1 0 0 0 0 M CHG 2 4 -1 6 1 M END $$$$