B0BXF3 -OEChem-04022106332D 44 46 0 0 0 0 0 0 0999 V2000 8.0622 -0.0670 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.4330 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 1.0670 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 2.7990 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.5622 -0.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5622 0.7990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6901 -1.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1901 -2.7990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6065 -0.2623 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6065 -1.8717 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1901 -1.0670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1901 -1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6901 -1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1901 -2.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -0.5419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -0.5419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 -1.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.6870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7991 0.3271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.6870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5001 -0.5301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6531 -3.1090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5001 -3.3360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7270 -2.4890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 9 1 0 0 0 0 1 13 1 0 0 0 0 2 27 1 0 0 0 0 3 27 1 0 0 0 0 4 27 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 28 2 0 0 0 0 9 15 1 0 0 0 0 9 33 1 0 0 0 0 10 14 1 0 0 0 0 10 21 1 0 0 0 0 10 36 1 0 0 0 0 11 17 1 0 0 0 0 11 21 2 0 0 0 0 12 21 1 0 0 0 0 12 28 1 0 0 0 0 12 41 1 0 0 0 0 13 16 2 0 0 0 0 13 18 1 0 0 0 0 14 16 1 0 0 0 0 14 17 2 0 0 0 0 15 19 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 32 1 0 0 0 0 17 20 1 0 0 0 0 18 20 2 0 0 0 0 18 34 1 0 0 0 0 19 22 2 0 0 0 0 19 23 1 0 0 0 0 20 35 1 0 0 0 0 22 25 1 0 0 0 0 22 37 1 0 0 0 0 23 26 2 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 29 42 1 0 0 0 0 29 43 1 0 0 0 0 29 44 1 0 0 0 0 M END $$$$