B4P9TV -OEChem-04022101562D 42 44 0 0 0 0 0 0 0999 V2000 6.3871 -0.6059 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1084 -2.3659 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4932 -3.4874 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.4819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.4819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4638 -5.9819 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.3298 -4.4819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.9819 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0052 -0.6059 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6962 -1.5569 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0151 -4.1455 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4638 -4.9819 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.3301 2.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.0181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6962 -1.5569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 5.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5151 -3.2795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5978 -4.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6842 -4.8887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9407 2.3743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 3.0645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 1.5896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 0.8993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 4.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.8619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 2.6719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 5.4450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 6.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 6.5188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 4.5188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.6719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 3.4450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5553 -5.4951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 22 1 0 0 0 0 2 25 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 18 1 0 0 0 0 4 23 1 0 0 0 0 5 19 1 0 0 0 0 5 24 1 0 0 0 0 6 12 1 0 0 0 0 7 12 2 0 0 0 0 8 15 1 0 0 0 0 8 21 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 21 2 0 0 0 0 10 22 2 0 0 0 0 11 25 2 0 0 0 0 11 27 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 18 1 0 0 0 0 16 32 1 0 0 0 0 17 20 2 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 26 27 2 0 0 0 0 27 42 1 0 0 0 0 M CHG 2 6 -1 12 1 M END $$$$