B3UKR2 -OEChem-04012114562D 38 38 0 1 0 0 0 0 0999 V2000 2.8660 0.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 5.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 5.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.9050 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8660 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -0.8224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -1.5127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 2.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 1.4873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 3.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 3.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9407 3.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -5.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 5.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 18 1 0 0 0 0 2 37 1 0 0 0 0 3 19 2 0 0 0 0 4 21 1 0 0 0 0 4 38 1 0 0 0 0 5 21 2 0 0 0 0 6 12 1 0 0 0 0 6 15 1 0 0 0 0 6 25 1 0 0 0 0 9 7 1 1 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 13 16 1 0 0 0 0 13 28 1 0 0 0 0 14 17 2 0 0 0 0 14 29 1 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 18 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 M END $$$$