RDKit 3D 52 56 0 0 0 0 0 0 0 0999 V2000 5.6081 -2.1444 1.3407 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6504 -1.0638 1.8467 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4739 0.1141 2.3746 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7255 -0.6063 0.7155 N 0 0 0 0 0 4 0 0 0 0 0 0 2.8372 -1.7288 0.1538 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1172 -1.2836 -1.1321 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4738 0.0544 -0.9681 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8306 0.8947 0.0695 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9523 2.3541 0.0651 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1234 1.9032 -1.3444 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4797 0.6584 -1.8019 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1712 0.1956 -2.9995 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1478 0.7783 -3.5859 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6759 1.9853 -2.9155 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7875 2.6695 -1.9746 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0160 1.6312 -2.3293 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3079 1.7305 -2.7975 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1443 1.2111 -1.7783 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3202 0.8187 -0.7413 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 1.0780 -1.0787 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5378 0.2137 0.5714 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4697 0.0025 1.4601 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6791 -0.5757 2.7151 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9623 -0.9538 3.1018 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0286 -0.7464 2.2314 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8248 -0.1690 0.9759 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7720 -1.2527 2.7555 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.3096 -0.9376 -3.5411 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8542 0.5983 1.1086 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0899 -3.0874 1.1363 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3651 -2.3727 2.0998 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1272 -1.8268 0.4285 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0110 -1.4634 2.6427 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2161 -0.2292 3.1044 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8497 0.8473 2.8929 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0091 0.6227 1.5652 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3167 -0.2754 -0.0581 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1317 -1.9997 0.9478 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4688 -2.5875 -0.0806 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3705 -2.0417 -1.3934 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8406 -1.2298 -1.9547 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8642 2.7125 -3.7162 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2507 3.4045 -1.4477 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6097 2.1214 -3.7589 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2217 1.1313 -1.8051 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4604 0.2987 1.1804 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 -0.7262 3.3917 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1220 -1.4002 4.0796 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6763 -0.0198 0.3164 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2304 -1.1138 -4.3323 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5305 1.4516 1.2202 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3828 0.3539 2.0673 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 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 19 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 25 27 1 0 12 28 1 0 8 29 1 0 29 4 1 0 11 7 1 0 15 10 1 0 20 16 1 0 26 21 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 3 34 1 0 3 35 1 0 3 36 1 0 4 37 1 0 5 38 1 0 5 39 1 0 6 40 1 0 6 41 1 0 14 42 1 6 15 43 1 0 17 44 1 0 18 45 1 0 22 46 1 0 23 47 1 0 24 48 1 0 26 49 1 0 28 50 1 0 29 51 1 0 29 52 1 0 M CHG 1 4 1 M END