RDKit 3D 60 66 0 0 0 0 0 0 0 0999 V2000 5.0886 -1.8790 -1.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4046 -1.2327 -0.8329 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9279 -0.0043 -0.5135 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8099 1.0179 -0.6918 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4440 1.1913 -2.1499 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5117 1.7330 -2.8278 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7113 0.4609 0.0042 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9215 0.5001 1.3487 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7763 -0.2670 2.0319 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4910 0.4625 1.8455 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5861 -0.2401 1.1601 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5323 -1.5089 0.8319 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -2.2293 1.1133 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7451 -1.6595 1.6568 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 -2.8416 1.9698 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.7056 -1.9855 0.2089 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4966 -0.9834 0.1516 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7854 -0.9036 -0.3677 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4988 0.2684 -0.3444 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9388 1.3930 0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6344 1.3406 0.7343 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9483 0.1587 0.6963 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3191 2.6532 1.2295 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7916 3.3891 2.0752 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.3700 3.3925 0.9923 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3693 2.6131 0.3573 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7998 0.0020 -0.9643 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8692 0.7363 -1.2112 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0288 0.1464 -1.8609 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9254 0.8418 -2.4303 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1976 -1.3298 -1.8746 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8953 -2.0284 -1.9841 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8135 -3.0915 -2.6134 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7375 -1.4183 -1.3296 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6098 -1.8819 -0.9837 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2254 0.1900 1.9103 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6207 1.2908 2.7425 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3494 0.0401 0.9188 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1112 -1.0752 1.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0946 -1.3148 -2.7938 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1281 -2.0599 -1.4581 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6399 -2.8974 -1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8135 0.2679 -1.1287 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1241 1.9757 -0.2792 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6074 1.8991 -2.1919 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1130 0.2526 -2.6175 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0585 2.3159 -2.2105 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 1.5873 1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0276 -0.2070 3.1515 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1334 0.8574 2.8491 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7953 1.3319 1.1609 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7771 -3.2950 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3588 2.9713 0.0405 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9284 1.7747 -0.9498 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8534 -1.6743 -2.6743 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7120 -1.5823 -0.9021 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2793 -0.6586 2.6477 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1872 1.2121 3.6261 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0701 0.9080 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0806 -0.9266 1.1622 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 6 1 0 4 7 1 0 7 8 1 0 8 36 1 0 36 37 1 0 36 38 1 0 38 39 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 12 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 26 2 0 26 25 1 0 25 23 2 0 23 24 1 0 23 21 1 0 21 22 2 0 19 27 1 0 27 28 2 0 28 29 1 0 29 30 2 0 29 31 1 0 31 32 1 0 32 33 2 0 32 34 1 0 34 35 2 0 38 3 1 0 14 9 1 0 22 17 1 0 34 27 1 0 22 11 1 0 35 18 1 0 21 20 1 0 1 40 1 0 1 41 1 0 1 42 1 0 3 43 1 6 4 44 1 1 5 45 1 0 5 46 1 0 6 47 1 0 8 48 1 1 36 57 1 1 37 58 1 0 38 59 1 6 39 60 1 0 9 49 1 1 10 50 1 0 10 51 1 0 13 52 1 0 26 53 1 0 28 54 1 0 31 55 1 0 31 56 1 0 M END