B9MC2I -OEChem-04012112452D 39 40 0 0 0 0 0 0 0999 V2000 7.7331 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5335 1.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7365 1.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6025 0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3996 0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2656 1.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4685 1.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6002 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6002 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 10 1 0 0 0 0 2 12 1 0 0 0 0 2 37 1 0 0 0 0 3 12 2 0 0 0 0 4 11 2 0 0 0 0 5 6 1 0 0 0 0 5 14 2 0 0 0 0 6 22 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 12 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 19 1 0 0 0 0 15 17 1 0 0 0 0 15 31 1 0 0 0 0 16 18 2 0 0 0 0 16 32 1 0 0 0 0 17 20 2 0 0 0 0 17 33 1 0 0 0 0 18 20 1 0 0 0 0 18 34 1 0 0 0 0 19 21 2 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 M END $$$$