LL9MQ4 -OEChem-05032301533D 35 38 0 1 0 0 0 0 0999 V2000 -3.8367 -0.1287 -1.1652 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9018 -1.0852 -1.4897 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5786 0.4650 0.4114 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7304 -0.3377 1.0679 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7057 -1.5785 0.8873 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8985 -0.8467 0.6088 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0201 -0.0943 -0.8832 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 -1.9714 0.2561 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 0.7250 -0.1347 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8297 2.0411 0.6373 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7237 -0.2156 0.3866 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4547 2.6945 0.6004 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6362 1.7540 1.1091 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1527 0.0670 -0.0159 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7263 -0.3356 0.3527 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8929 0.1347 -0.2484 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9812 -0.7293 -0.2563 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3063 1.3265 -0.8968 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9921 -0.7326 -0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6206 1.1571 -1.2773 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8404 -2.3093 0.8069 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6204 0.9393 -1.1945 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 1.8739 1.6815 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5754 2.7220 0.2092 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9628 -0.5769 1.3955 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6871 -1.0966 -0.2683 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2245 2.9901 -0.4311 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4623 3.6105 1.2016 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6039 2.2513 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4993 1.5792 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7183 2.2143 -1.0841 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9388 -0.4879 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5709 -1.2453 1.2519 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3050 1.8139 -1.7954 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7908 -3.3005 1.2446 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 19 1 0 0 0 0 2 19 2 0 0 0 0 3 11 1 0 0 0 0 3 13 1 0 0 0 0 3 15 1 0 0 0 0 4 6 1 0 0 0 0 4 14 2 0 0 0 0 5 15 2 0 0 0 0 5 21 1 0 0 0 0 6 19 1 0 0 0 0 6 33 1 0 0 0 0 7 17 1 0 0 0 0 7 20 1 0 0 0 0 7 32 1 0 0 0 0 8 17 1 0 0 0 0 8 21 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 9 22 1 0 0 0 0 10 12 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 20 2 0 0 0 0 18 31 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 M END $$$$