D05OTR -OEChem-10101305022D 41 42 0 1 0 0 0 0 0999 V2000 3.7320 -1.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 5.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.5950 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7320 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.0950 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 2.8660 -3.4050 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 3.7320 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 2.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 1.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 3.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 4.6319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 3.5581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -1.8224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -2.5127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 5.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 5.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -5.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 15 1 0 0 0 0 2 14 2 0 0 0 0 3 5 1 0 0 0 0 6 3 1 1 0 0 0 3 25 1 0 0 0 0 4 14 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 6 24 1 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 12 1 0 0 0 0 9 29 1 0 0 0 0 10 13 2 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 17 35 1 0 0 0 0 18 20 2 0 0 0 0 18 36 1 0 0 0 0 19 21 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 M END $$$$