B47EGW -OEChem-04022102582D 40 42 0 0 0 0 0 0 0999 V2000 4.5981 4.4206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.4206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1813 -4.3543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 -1.1182 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5211 -0.1671 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8301 -1.1182 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.4206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.9206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.4207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.9207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1391 -0.1671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.4206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4179 -1.9272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.9207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.9206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4124 -1.8227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0112 -2.8408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0002 -2.6317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5990 -3.6498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5935 -3.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.9206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.9207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9407 1.3130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 2.0033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.2306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7288 0.0245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6646 -1.2563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3946 -2.9056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6168 -2.5669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3468 -4.2162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 4.3837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 5.2306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 5.4576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 3.4576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 2.3837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9291 -4.9206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 22 1 0 0 0 0 2 15 1 0 0 0 0 2 23 1 0 0 0 0 3 21 1 0 0 0 0 3 40 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 4 14 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 10 2 0 0 0 0 8 12 1 0 0 0 0 9 11 2 0 0 0 0 10 13 1 0 0 0 0 10 26 1 0 0 0 0 11 27 1 0 0 0 0 12 16 2 0 0 0 0 12 28 1 0 0 0 0 13 15 2 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 29 1 0 0 0 0 17 19 1 0 0 0 0 17 30 1 0 0 0 0 18 20 2 0 0 0 0 18 31 1 0 0 0 0 19 21 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END $$$$