B9JP5V -OEChem-04012113542D 55 58 0 0 0 0 0 0 0999 V2000 3.7320 1.7694 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.7306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7026 3.2640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3077 7.1260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5116 1.8627 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 2.6058 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -7.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 3.4719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0875 4.3854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4997 5.1944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 4.4899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9064 6.1080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 5.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9010 6.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3022 7.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -2.8132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -2.1229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -2.1229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -2.8132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -1.3382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -0.6480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -0.6480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -1.3382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.9206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.9206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 0.1868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 0.8771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.5406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -5.5406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -6.6936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -7.5406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -7.7675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8831 5.1296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4464 3.9883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5420 6.6096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1054 5.4683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3670 6.6140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9188 7.2954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2374 7.8472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 22 1 0 0 0 0 2 15 2 0 0 0 0 3 21 1 0 0 0 0 3 23 1 0 0 0 0 4 22 1 0 0 0 0 4 24 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 14 1 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 22 2 0 0 0 0 9 24 2 0 0 0 0 10 12 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 13 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 15 18 1 0 0 0 0 16 19 1 0 0 0 0 16 40 1 0 0 0 0 17 20 2 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 21 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 26 49 1 0 0 0 0 27 29 2 0 0 0 0 27 50 1 0 0 0 0 28 30 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END $$$$