BL51JC -OEChem-04012113052D 39 42 0 1 0 0 0 0 0999 V2000 6.8958 2.7680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -0.2320 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4989 -0.3991 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 1.2680 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0836 -0.0368 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0836 1.5727 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1051 -1.2039 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0938 -1.3069 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7062 -2.1080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2976 -2.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4418 -2.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 0.2680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0298 0.2680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0298 1.2680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 1.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6279 1.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 0.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2594 -1.1176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9390 -1.3969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1684 -1.7996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3430 -2.6104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5494 -2.8404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8874 -2.0830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9815 -3.1834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8065 -3.2693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8910 2.1620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9379 1.2310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1648 2.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3179 2.3049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6077 1.3785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9174 0.9800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8923 -0.7086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5826 -0.3101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -0.0981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 7 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 3 8 1 0 0 0 0 3 12 2 0 0 0 0 4 12 1 0 0 0 0 4 15 1 0 0 0 0 4 17 1 0 0 0 0 5 13 1 0 0 0 0 5 16 2 0 0 0 0 6 14 1 0 0 0 0 6 16 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 1 0 0 0 8 10 1 0 0 0 0 8 22 1 1 0 0 0 9 11 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 16 18 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 M END $$$$