BY0TR9 -OEChem-04022103012D 40 42 0 0 0 0 0 0 0999 V2000 5.6808 2.4309 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.7715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.7715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.7285 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1504 4.2934 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9813 2.6842 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.2285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7026 2.2230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9595 2.8921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 3.8866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5116 0.8217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.2715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4813 3.5502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.2715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.7715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9425 5.2715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.2715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -0.1889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -0.8792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.0385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6009 4.1966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6405 0.2153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.9615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.9615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7974 1.5001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8647 3.6150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.5815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.5815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5490 5.4004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8136 5.8780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3361 5.1426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -4.7346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -5.5815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -5.8085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 17 1 0 0 0 0 2 12 2 0 0 0 0 3 21 1 0 0 0 0 3 23 1 0 0 0 0 4 7 1 0 0 0 0 4 12 1 0 0 0 0 4 26 1 0 0 0 0 5 13 1 0 0 0 0 5 18 1 0 0 0 0 5 22 1 0 0 0 0 6 10 1 0 0 0 0 6 18 2 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 13 2 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 13 27 1 0 0 0 0 14 17 2 0 0 0 0 14 28 1 0 0 0 0 15 19 1 0 0 0 0 15 29 1 0 0 0 0 16 20 2 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 19 21 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M END $$$$