D00UTU -OEChem-04152111043D 37 40 0 0 0 0 0 0 0999 V2000 5.6793 0.8197 -0.6681 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6229 0.1987 -2.9946 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1485 -1.7916 -0.0052 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0098 -4.0441 0.5197 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5019 0.5135 -1.6423 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6455 1.6474 -0.3596 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2351 -1.8080 0.2261 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5645 0.6113 -0.5635 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6097 0.8183 0.3797 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8809 0.5884 -0.3144 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8148 0.7519 -0.3229 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1443 0.4266 -1.7974 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6969 -0.6250 0.0388 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0561 -0.1511 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 1.2171 -0.0841 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6465 1.0565 1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0597 0.9123 0.2958 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 -0.7944 0.4484 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8844 1.2190 2.4004 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0992 2.0015 -0.0401 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0711 1.1475 1.6737 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3889 -0.0044 0.4923 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3201 1.3810 0.2503 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6431 -3.0487 0.1933 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1223 -3.0435 -0.0513 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1786 0.4159 -2.3865 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7297 1.1140 2.3478 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2845 -1.8603 0.6359 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9185 1.4025 3.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0551 3.0694 -0.2251 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0137 1.2788 2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3493 -0.4609 0.7167 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2288 1.9760 0.2904 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3513 0.1205 -3.6354 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6171 -2.4003 0.6804 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5107 -4.0600 0.0593 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3306 -2.7046 -1.0691 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 12 1 0 0 0 0 2 34 1 0 0 0 0 3 7 1 0 0 0 0 3 24 1 0 0 0 0 4 24 2 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 5 26 1 0 0 0 0 6 10 2 0 0 0 0 6 15 1 0 0 0 0 7 13 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 9 11 2 0 0 0 0 9 16 1 0 0 0 0 10 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 2 0 0 0 0 15 20 2 0 0 0 0 16 19 2 0 0 0 0 16 27 1 0 0 0 0 17 21 2 0 0 0 0 18 22 1 0 0 0 0 18 28 1 0 0 0 0 19 21 1 0 0 0 0 19 29 1 0 0 0 0 20 23 1 0 0 0 0 20 30 1 0 0 0 0 21 31 1 0 0 0 0 22 23 2 0 0 0 0 22 32 1 0 0 0 0 23 33 1 0 0 0 0 24 25 1 0 0 0 0 25 35 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 M END $$$$