B0MJA9 -OEChem-04022108402D 42 44 0 1 0 0 0 0 0999 V2000 5.4641 -1.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8418 1.4921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.3988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.8988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.1012 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1962 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0327 2.8933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0109 3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 2.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.0888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8501 1.9814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4516 1.2911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -2.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -2.0762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -2.0762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -2.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5720 3.3082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2631 3.6676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1275 2.1704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 12 1 0 0 0 0 2 10 1 0 0 0 0 2 21 1 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 3 26 1 0 0 0 0 4 16 3 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 9 2 0 0 0 0 7 11 2 0 0 0 0 8 10 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 13 1 0 0 0 0 9 29 1 0 0 0 0 10 17 2 0 0 0 0 11 15 1 0 0 0 0 11 30 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 15 2 0 0 0 0 13 33 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 34 1 0 0 0 0 17 20 1 0 0 0 0 17 35 1 0 0 0 0 18 22 1 0 0 0 0 18 36 1 0 0 0 0 19 23 2 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 24 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 M END $$$$