RDKit 3D 45 48 0 0 0 0 0 0 0 0999 V2000 6.7836 0.2525 -0.3737 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9864 -0.5858 -1.3766 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3786 -2.0632 -1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4923 -0.3853 -1.1965 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7451 0.2305 -2.2114 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3704 0.4347 -2.0622 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7147 0.0169 -0.8992 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4535 -0.5865 0.1235 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8300 -0.7870 -0.0266 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2503 0.2658 -0.7727 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2803 1.2883 -1.3797 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6372 1.3846 -1.2202 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4348 1.7440 -2.1769 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7723 1.5766 -1.7087 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7311 1.1390 -0.4789 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3227 1.0134 0.0687 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7485 -0.3064 0.4502 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -0.7079 0.0486 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4835 -1.2057 1.4041 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9023 -2.2861 0.9149 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5566 -0.7519 2.5795 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.9576 0.8896 0.3074 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1449 0.5957 -0.3776 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3328 0.3845 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3337 0.4739 1.7178 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1611 0.7783 2.4065 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9738 0.9952 1.6999 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9392 0.1875 2.6753 Br 0 0 0 0 0 0 0 0 0 0 0 0 6.5988 -0.0599 0.6603 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5193 1.3131 -0.4536 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8589 0.1604 -0.5624 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2661 -0.2417 -2.3815 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2039 -2.4751 -0.2869 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4420 -2.1922 -1.5176 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8052 -2.6650 -2.0013 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 0.5627 -3.1291 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8093 0.9181 -2.8594 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9795 -0.8871 1.0546 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3790 -1.2541 0.7878 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1336 1.7848 0.8213 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1147 -1.6665 0.3338 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1433 0.5175 -1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2407 0.1437 -0.2176 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1462 0.8329 3.4915 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0703 1.2231 2.2601 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 7 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 2 0 19 21 1 0 15 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 25 28 1 0 9 4 1 0 18 10 1 0 16 12 1 0 27 22 1 0 1 29 1 0 1 30 1 0 1 31 1 0 2 32 1 0 3 33 1 0 3 34 1 0 3 35 1 0 5 36 1 0 6 37 1 0 8 38 1 0 9 39 1 0 16 40 1 1 18 41 1 0 23 42 1 0 24 43 1 0 26 44 1 0 27 45 1 0 M CHG 1 21 -1 M END