BGI86B -OEChem-04022113383D 33 34 0 0 0 0 0 0 0999 V2000 -3.5151 1.3682 0.7482 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.4703 0.4012 0.6152 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.5031 1.1100 -1.2118 F 0 0 0 0 0 0 0 0 0 0 0 0 3.5971 2.0727 -0.2256 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5898 1.7916 0.8931 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6717 -0.7328 -0.1419 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0658 -1.9985 -0.4415 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6223 -2.3836 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2444 -0.5818 0.0969 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9364 -1.0486 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8413 -0.0678 0.1162 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4718 -0.9661 -0.0562 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5799 1.3528 0.3189 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1638 -0.2038 -1.0363 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -1.6499 0.8954 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5561 -0.1255 -1.0653 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6775 -1.5714 0.8665 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3131 -0.8093 -0.1138 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4846 3.4948 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2776 0.5477 -0.0053 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2166 -2.0043 -1.5292 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7867 -2.6999 -0.0095 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2058 -3.0163 -0.9102 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5616 -2.9183 0.8345 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9141 -0.0142 -0.5558 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6601 -0.5927 1.1104 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4092 0.3312 -1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1925 -2.2453 1.6696 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0384 0.4654 -1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2619 -2.1051 1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5838 3.8466 -0.6189 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4685 3.7861 0.9475 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3589 3.9461 -0.5833 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 20 1 0 0 0 0 3 20 1 0 0 0 0 4 13 1 0 0 0 0 4 19 1 0 0 0 0 5 13 2 0 0 0 0 6 18 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 11 13 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 15 17 2 0 0 0 0 15 28 1 0 0 0 0 16 18 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 M END $$$$