BM4V1E -OEChem-04022106042D 34 37 0 0 0 0 0 0 0999 V2000 5.1574 -1.1948 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2410 -1.2560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.6791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2111 0.1100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1574 0.4147 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6723 -0.3900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 -1.1990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 0.4190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2111 -0.8900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 -0.3900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7410 -0.3900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 1.3701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2410 -1.2560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7410 -2.1221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7410 -2.1221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5388 2.1791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7410 -0.3900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2410 -1.2560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7410 -0.3900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 2.9881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2410 -2.9881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.6791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3236 -0.1780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6333 0.2206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4310 -2.6590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1588 2.1791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4310 0.1469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8610 -1.2560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0510 0.1469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1426 3.5778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7040 -3.2981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5510 -3.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7779 -2.6781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4984 3.0435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 11 1 0 0 0 0 2 13 1 0 0 0 0 3 12 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 5 10 2 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 9 2 0 0 0 0 8 12 1 0 0 0 0 10 11 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 16 2 0 0 0 0 13 15 1 0 0 0 0 13 17 2 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 14 21 1 0 0 0 0 15 25 1 0 0 0 0 16 20 1 0 0 0 0 16 26 1 0 0 0 0 17 19 1 0 0 0 0 17 27 1 0 0 0 0 18 19 2 0 0 0 0 18 28 1 0 0 0 0 19 29 1 0 0 0 0 20 22 2 0 0 0 0 20 30 1 0 0 0 0 21 31 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 M END $$$$