B6BP3D -OEChem-04022103293D 39 41 0 0 0 0 0 0 0999 V2000 5.3126 -2.1443 -1.1149 F 0 0 0 0 0 0 0 0 0 0 0 0 5.3400 -2.1501 1.0648 F 0 0 0 0 0 0 0 0 0 0 0 0 6.8808 -1.0759 -0.0416 F 0 0 0 0 0 0 0 0 0 0 0 0 4.8753 3.3851 0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2076 0.5285 0.0429 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0646 1.9452 0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 -0.3891 0.0078 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -0.5641 0.0331 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5509 -0.7422 0.0472 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7118 -0.2324 0.0062 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6106 -0.1880 1.1981 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6583 -0.7742 -1.1453 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9956 -0.0223 1.1847 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -0.6083 -1.1587 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1483 -0.0611 -0.0074 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5724 0.6469 0.0235 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7904 0.3495 -1.1756 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8912 -0.3067 1.1473 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7221 -0.1566 -0.0103 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4105 2.2506 0.0036 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2873 1.0612 -0.0128 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1755 0.5148 -1.1891 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2761 -0.1415 1.1339 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9183 0.2693 -0.0344 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5719 -1.3942 -0.0261 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8321 -1.3188 0.9376 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8637 -1.3358 -0.8208 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0617 -0.0152 2.1201 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1504 -1.0719 -2.0588 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4689 0.3009 2.1078 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5615 -0.8124 -2.0915 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6407 1.3719 0.0523 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2510 0.5820 -2.0897 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4390 -0.6574 2.0709 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3997 2.7129 0.0346 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3582 1.2228 -0.0267 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6753 0.8411 -2.0965 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8560 -0.3391 2.0308 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9967 0.3979 -0.0447 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 25 1 0 0 0 0 3 25 1 0 0 0 0 4 20 2 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 5 32 1 0 0 0 0 6 16 1 0 0 0 0 6 20 1 0 0 0 0 6 35 1 0 0 0 0 7 16 2 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 11 13 1 0 0 0 0 11 28 1 0 0 0 0 12 14 2 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 17 22 1 0 0 0 0 17 33 1 0 0 0 0 18 23 2 0 0 0 0 18 34 1 0 0 0 0 19 21 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 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 $$$$