B12CRJ -OEChem-04012117582D 54 53 0 1 0 0 0 0 0999 V2000 6.3301 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4641 0.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.7942 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4282 -0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4282 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 -0.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4842 1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8913 -1.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7382 -1.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9651 -0.5560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9651 1.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1182 1.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8913 0.5560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 0.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 1.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 1.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 0.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 2.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 3.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3082 -3.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -3.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5482 -3.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 -2.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4842 -0.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 3.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 2.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 16 2 0 0 0 0 3 7 1 0 0 0 0 3 54 1 0 0 0 0 4 23 2 0 0 0 0 9 5 1 1 0 0 0 5 15 1 0 0 0 0 5 26 1 0 0 0 0 6 16 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 17 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 16 1 0 0 0 0 9 24 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 10 17 1 0 0 0 0 10 25 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 18 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 22 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 53 1 0 0 0 0 M END $$$$