RDKit 3D 29 31 0 0 0 0 0 0 0 0999 V2000 4.4387 -1.1933 1.2773 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2154 -0.4711 1.0537 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2793 -0.8744 0.3085 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 0.0749 0.2894 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0626 -0.2016 -0.3656 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0043 -1.5195 -1.0412 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3392 -2.1138 -1.2347 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3761 -1.8481 -0.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9795 -0.5539 0.0097 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1292 -0.4979 0.4605 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 0.7405 -0.2088 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 1.9530 -0.3177 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9174 2.8714 -0.5729 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1307 4.7500 -0.8213 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.6978 2.1830 -0.6262 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9397 0.8507 -0.3968 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5981 1.1355 1.1533 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9812 2.1744 1.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9113 0.7804 1.6436 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1676 -1.2016 0.5443 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6146 -1.7095 2.1561 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4763 -1.4341 -2.0533 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6455 -2.2424 -0.4932 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7496 -1.9141 -2.2692 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2074 -3.2347 -1.2421 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7709 -2.6469 0.3155 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8754 2.1534 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2696 2.6156 -0.8421 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4659 1.3741 2.2981 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 17 1 0 17 18 2 0 17 19 1 0 4 5 2 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 16 2 0 16 15 1 0 15 13 2 0 13 14 1 0 13 12 1 0 19 2 1 0 16 5 1 0 12 11 1 0 1 20 1 0 1 21 1 0 19 29 1 0 6 22 1 0 6 23 1 0 7 24 1 0 7 25 1 0 8 26 1 0 15 28 1 0 12 27 1 0 M END