B8R9BM -OEChem-04012112092D 51 54 0 0 0 0 0 0 0999 V2000 8.0622 2.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 14.7194 -0.8190 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 13.7014 0.5823 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.0458 -0.6910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0458 -2.3090 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9969 -2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8744 -0.6953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1851 0.2553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4580 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8744 -2.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1636 0.4615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5172 0.9996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4580 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9969 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8059 -0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3777 0.8446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0670 -2.8940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2914 -0.1452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7703 0.5893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0357 1.0682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9787 1.4136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1032 1.4610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0558 0.5855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 -2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8707 -1.0288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 1.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 4 32 1 0 0 0 0 5 23 1 0 0 0 0 5 27 1 0 0 0 0 6 33 2 0 0 0 0 7 14 1 0 0 0 0 7 34 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 8 19 1 0 0 0 0 9 22 1 0 0 0 0 9 25 1 0 0 0 0 9 43 1 0 0 0 0 10 24 2 0 0 0 0 11 22 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 23 2 0 0 0 0 13 27 2 0 0 0 0 14 33 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 20 1 0 0 0 0 16 21 1 0 0 0 0 16 35 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 28 2 0 0 0 0 26 29 2 0 0 0 0 26 45 1 0 0 0 0 27 32 1 0 0 0 0 28 30 1 0 0 0 0 29 31 1 0 0 0 0 29 33 1 0 0 0 0 30 31 2 0 0 0 0 30 46 1 0 0 0 0 32 47 1 0 0 0 0 34 49 1 0 0 0 0 34 50 1 0 0 0 0 34 51 1 0 0 0 0 M END $$$$