RDKit 3D 45 46 0 0 0 0 0 0 0 0999 V2000 0.9485 1.2782 -2.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6172 1.2388 -0.8787 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3865 1.9958 0.1624 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0753 0.9215 0.9680 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8513 0.0572 0.2006 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2072 -0.0777 0.4403 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1046 -0.9666 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6946 0.6055 1.3673 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0096 0.1428 1.6845 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2976 1.2827 3.0810 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0635 -0.4185 0.8218 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -1.7126 0.1878 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1788 -0.8826 1.7103 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5348 0.4513 -0.2937 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0871 -0.3709 -1.4614 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4376 -0.9333 -1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3029 -0.0066 -0.7243 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6675 -0.3367 -0.3039 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8403 1.3937 -0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 1.4668 0.0688 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8122 1.8859 -2.4191 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4313 0.7486 -2.9111 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 2.7459 -0.2523 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 2.4783 0.8364 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6798 1.4407 1.7408 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7589 -1.1287 -1.3636 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0888 -0.4252 -0.4224 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3388 -1.9043 0.2055 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5266 -0.6918 2.2104 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3679 -2.3375 -0.1518 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9641 -2.2604 1.0224 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2366 -1.5135 -0.5621 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9033 -1.5700 1.2294 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6623 -1.5759 2.4634 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6241 -0.1160 2.3569 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3612 0.3085 -2.3122 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4055 -1.1150 -1.8474 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6888 -1.9656 -1.0467 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3510 0.5550 -0.3911 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1082 -1.1745 -0.8697 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7276 -0.6107 0.7888 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5658 2.0973 -0.3157 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6697 1.7685 -1.8157 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1367 2.4945 -0.0064 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9647 1.3783 1.1087 H 0 0 0 0 0 0 0 0 0 0 0 0 7 6 1 0 6 8 2 0 6 5 1 0 5 4 1 0 4 3 1 0 3 2 1 0 2 1 2 3 14 2 1 6 14 20 1 0 20 19 1 0 19 17 1 0 17 18 1 0 17 16 2 0 16 15 1 0 14 11 1 0 11 12 1 0 11 13 1 0 11 9 1 0 9 10 1 0 9 4 1 0 15 14 1 0 7 26 1 0 7 27 1 0 7 28 1 0 4 25 1 1 3 23 1 0 3 24 1 0 1 21 1 0 1 22 1 0 20 44 1 0 20 45 1 0 19 42 1 0 19 43 1 0 18 39 1 0 18 40 1 0 18 41 1 0 16 38 1 0 15 36 1 0 15 37 1 0 12 30 1 0 12 31 1 0 12 32 1 0 13 33 1 0 13 34 1 0 13 35 1 0 9 29 1 1 M END