RDKit 3D 39 42 0 0 0 0 0 0 0 0999 V2000 -1.4261 -0.7751 2.0045 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3193 -1.6359 0.8416 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0295 -2.1125 0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9577 -1.0648 0.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -0.8290 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2454 -1.5387 1.1446 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5423 -1.0692 1.1469 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8679 0.0999 0.4931 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1926 0.5378 0.5213 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9124 0.8188 -0.1714 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 2.4473 -1.0807 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.6199 0.3548 -0.1761 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4599 0.8374 -0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1228 1.9520 -1.5103 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2114 2.0715 -1.8877 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1502 1.1517 -1.5283 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 0.0810 -0.7903 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4769 -0.0592 -0.4051 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7953 -0.9695 -0.3537 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0934 -0.2697 0.0221 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7800 0.6012 -1.4085 S 0 0 0 0 0 4 0 0 0 0 0 0 -5.2976 1.4073 -0.9303 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9387 -0.3154 -2.5883 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4413 -0.7965 2.4069 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0863 0.2569 1.7113 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -1.0888 2.7957 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3444 -2.3631 1.8051 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1538 -3.0324 0.1745 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9855 -2.4691 1.6646 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2917 -1.6490 1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4470 1.3772 0.0567 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8781 2.6507 -1.7737 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4787 2.9251 -2.4797 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9656 -1.6945 -1.1471 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8679 -0.9758 0.3636 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9156 0.4661 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5857 2.2297 -1.6138 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1789 1.8080 0.0964 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1100 0.6338 -0.8592 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 12 2 0 12 13 1 0 13 18 1 0 18 17 2 0 17 16 1 0 16 15 2 0 15 14 1 0 17 19 1 0 19 20 1 0 21 20 1 1 21 22 1 0 21 23 2 0 12 10 1 0 10 11 1 0 10 8 2 0 8 9 1 0 8 7 1 0 7 6 2 0 19 2 1 0 18 4 1 0 6 5 1 0 14 13 2 0 1 24 1 0 1 25 1 0 1 26 1 0 3 27 1 0 3 28 1 0 15 33 1 0 14 32 1 0 19 34 1 6 20 35 1 0 20 36 1 0 22 37 1 0 22 38 1 0 22 39 1 0 9 31 1 0 7 30 1 0 6 29 1 0 M END