L4DOQ5 -OEChem-05032301002D 39 41 0 0 0 0 0 0 0999 V2000 3.0000 1.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 4.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 4.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2554 3.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4631 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 1.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8101 1.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2087 2.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -3.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -3.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -4.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -4.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -5.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 6 1 0 0 0 0 1 9 1 0 0 0 0 4 12 2 0 0 0 0 5 13 2 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 10 2 0 0 0 0 8 12 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 15 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 14 17 2 0 0 0 0 14 18 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 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 35 1 0 0 0 0 21 23 2 0 0 0 0 21 36 1 0 0 0 0 22 24 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 M END $$$$