D00471 -OEChem-05072121522D 44 47 0 1 0 0 0 0 0999 V2000 4.2690 -1.6415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2988 1.7245 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7988 0.8585 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2152 0.0538 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.6415 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7988 0.8585 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2988 -0.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2988 1.7245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2988 -0.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7988 0.8585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7988 0.8585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2988 -0.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2988 1.7245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7988 0.8585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2988 -0.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2988 1.7245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.3585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2152 1.6632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.3585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.1415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.8585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.3585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.3585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.1415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4888 0.3216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7162 -0.2196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4065 -0.6181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4065 2.3351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7162 1.9366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1912 -0.6181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8814 -0.2196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2738 0.4600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2738 1.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6088 2.2615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6088 -0.5444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6088 2.2615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9888 -0.5444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9888 2.2615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4078 2.2526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.4785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.6685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.2615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 2 0 0 0 0 2 8 1 0 0 0 0 2 10 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 3 18 1 0 0 0 0 4 19 2 0 0 0 0 5 24 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 1 0 0 0 6 25 1 0 0 0 0 7 9 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 15 1 0 0 0 0 12 35 1 0 0 0 0 13 16 2 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 22 2 0 0 0 0 20 24 1 0 0 0 0 21 23 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 M END $$$$