RDKit 3D 31 33 0 0 0 0 0 0 0 0999 V2000 0.0441 -1.5475 -1.3863 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2978 -0.5669 -0.2243 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2506 -1.0912 1.0074 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5873 -1.0587 1.2721 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1042 -1.7929 2.1023 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3510 -0.0573 0.5142 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7298 0.0817 0.6948 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4174 1.0765 -0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7258 1.9302 -0.8631 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3472 1.7869 -1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6612 0.7823 -0.3564 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3145 0.6940 -0.5741 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7845 -0.2663 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -0.9904 -0.5837 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1687 -0.6823 -0.3133 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4820 0.3507 0.5653 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4702 1.0795 1.1798 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1349 0.7706 0.9082 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2908 0.7615 0.9268 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -1.1663 -2.3232 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4657 -2.5384 -1.1837 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0269 -1.6897 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2578 -1.8226 1.4847 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 -0.5728 1.3814 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4899 1.1929 0.1363 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2611 2.7112 -1.3981 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8116 2.4549 -1.7065 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6331 -1.8072 -1.2732 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9572 -1.2563 -0.7938 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 1.8859 1.8697 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3525 1.3480 1.4007 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 6 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 2 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 16 19 1 0 12 2 1 0 11 6 1 0 18 13 1 0 1 20 1 0 1 21 1 0 1 22 1 0 3 23 1 0 7 24 1 0 8 25 1 0 9 26 1 0 10 27 1 0 14 28 1 0 15 29 1 0 17 30 1 0 18 31 1 0 M END