B2MZ1W -OEChem-04022113403D 43 45 0 1 0 0 0 0 0999 V2000 -5.2069 -2.2077 0.1888 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.6535 -0.6287 1.6062 F 0 0 0 0 0 0 0 0 0 0 0 0 2.5458 0.5160 -2.6238 F 0 0 0 0 0 0 0 0 0 0 0 0 3.6739 -2.6710 1.6753 F 0 0 0 0 0 0 0 0 0 0 0 0 2.7227 -3.7751 -0.6382 F 0 0 0 0 0 0 0 0 0 0 0 0 1.1524 0.5590 2.0695 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 0.6134 0.4281 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1804 0.0479 -0.0121 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4680 1.4464 -1.6590 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0585 3.9200 0.8243 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6782 0.8363 -1.3767 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0057 -0.7239 0.7691 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5058 -0.6780 1.0381 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1234 1.2804 -0.7299 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 0.9613 -0.8251 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1905 2.4111 0.5891 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7009 2.4952 0.8118 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6229 1.1105 1.1017 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5245 1.7952 -0.2914 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4817 -0.0013 -0.3819 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3089 0.3044 -0.3859 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4863 -0.8646 0.2632 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8239 -0.2589 -1.5663 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5957 -0.5104 0.7091 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3976 -1.8886 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6258 -1.6370 -1.6516 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9127 -2.4518 -0.5565 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4822 -1.1369 1.6369 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7847 -1.3743 -0.0866 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9145 -1.6907 1.0957 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7194 -0.1477 1.9727 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 0.9428 -1.6294 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0232 2.3654 -0.6459 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6604 3.2021 1.1357 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.5574 -0.4772 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9795 2.0933 1.7923 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3138 2.2687 -1.2596 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5965 1.9593 -0.1126 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0582 4.0201 0.9969 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5879 4.3858 1.5994 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4642 -0.7207 -0.2054 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9853 -0.0894 1.6318 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2478 -2.0753 -2.5702 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 22 1 0 0 0 0 3 23 1 0 0 0 0 4 25 1 0 0 0 0 5 27 1 0 0 0 0 6 18 2 0 0 0 0 7 12 1 0 0 0 0 7 14 1 0 0 0 0 7 18 1 0 0 0 0 8 13 1 0 0 0 0 8 15 1 0 0 0 0 8 20 1 0 0 0 0 9 11 1 0 0 0 0 9 15 2 0 0 0 0 10 17 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 20 2 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 19 1 0 0 0 0 17 36 1 0 0 0 0 19 21 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 2 0 0 0 0 22 41 1 0 0 0 0 23 26 2 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 27 2 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 M END $$$$