BCHG98 -OEChem-04012115412D 41 43 0 0 0 0 0 0 0999 V2000 6.3776 0.3593 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.7340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8255 2.4297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3924 4.2340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5468 1.9685 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0413 0.9979 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.7340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.7660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.2660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.7340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5686 1.7606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 1.1024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6291 1.8069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2224 2.7205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6236 1.7024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8101 3.5295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2114 2.5114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8047 3.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 0.5760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.9240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.9240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.5440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7990 2.5349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6057 2.7853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8758 1.1360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5580 4.0959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8280 2.4466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.6970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.9240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.7709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 -4.7709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -4.5440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 -3.6970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0090 4.1692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 17 1 0 0 0 0 2 12 1 0 0 0 0 2 24 1 0 0 0 0 3 14 1 0 0 0 0 3 25 1 0 0 0 0 4 16 2 0 0 0 0 5 23 1 0 0 0 0 5 41 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 6 30 1 0 0 0 0 7 17 2 0 0 0 0 7 18 1 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 14 2 0 0 0 0 13 15 2 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 15 29 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 19 31 1 0 0 0 0 20 22 2 0 0 0 0 20 32 1 0 0 0 0 21 23 2 0 0 0 0 21 33 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 M END $$$$