BL20QS -OEChem-04022105532D 45 47 0 0 0 0 0 0 0999 V2000 13.7953 2.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9326 0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7297 0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8637 1.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0666 1.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4662 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 7 1 0 0 0 0 2 10 1 0 0 0 0 3 26 2 0 0 0 0 4 9 1 0 0 0 0 4 11 1 0 0 0 0 4 32 1 0 0 0 0 5 26 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 15 2 0 0 0 0 8 16 1 0 0 0 0 9 12 2 0 0 0 0 9 14 1 0 0 0 0 10 12 1 0 0 0 0 10 17 2 0 0 0 0 11 13 1 0 0 0 0 11 19 2 0 0 0 0 12 31 1 0 0 0 0 13 20 2 0 0 0 0 13 26 1 0 0 0 0 14 18 2 0 0 0 0 14 33 1 0 0 0 0 15 21 1 0 0 0 0 15 34 1 0 0 0 0 16 22 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 19 23 1 0 0 0 0 19 38 1 0 0 0 0 20 25 1 0 0 0 0 20 39 1 0 0 0 0 21 24 2 0 0 0 0 21 40 1 0 0 0 0 22 24 1 0 0 0 0 22 41 1 0 0 0 0 23 25 2 0 0 0 0 23 42 1 0 0 0 0 25 43 1 0 0 0 0 M END $$$$