B6YDU3 -OEChem-04022105423D 27 29 0 0 0 0 0 0 0999 V2000 -4.4861 0.3778 0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4289 -0.8136 -0.0002 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3787 1.4503 0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0588 1.7270 -0.0004 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0923 -0.3954 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2802 -0.3800 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0576 0.9867 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -1.1096 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2237 1.0442 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5214 -1.0359 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2639 0.3363 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8817 -2.1806 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4263 1.7430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 -0.3049 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6581 1.0839 0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6338 -2.5292 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0522 -2.1933 -0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6424 2.4277 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5058 -2.6840 -0.8954 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9745 -2.2164 0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5054 -2.6843 0.8947 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4196 2.8316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6738 -0.7989 0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5793 1.6595 0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1652 -2.9509 -0.8951 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 -2.8615 0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1645 -2.9508 0.8955 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 5 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 7 1 0 0 0 0 3 11 1 0 0 0 0 3 18 1 0 0 0 0 4 7 2 0 0 0 0 4 9 1 0 0 0 0 5 7 1 0 0 0 0 5 8 2 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 10 2 0 0 0 0 8 17 1 0 0 0 0 9 13 2 0 0 0 0 10 14 1 0 0 0 0 10 16 1 0 0 0 0 12 19 1 0 0 0 0 12 20 1 0 0 0 0 12 21 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 14 15 2 0 0 0 0 14 23 1 0 0 0 0 15 24 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 M END $$$$