RDKit 3D 52 56 0 0 0 0 0 0 0 0999 V2000 -6.0081 -0.8878 -1.0206 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0691 -1.4025 0.0674 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5912 -2.8193 -0.2226 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9143 -0.4338 0.2557 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.1376 -0.6577 1.5584 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2693 0.5702 1.8937 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 1.0536 0.6936 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8543 0.6486 -0.5861 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8418 1.3167 -1.7801 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 2.1840 -0.6149 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4055 1.9603 0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2888 2.6514 1.7208 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3633 3.3320 1.5802 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9507 3.3409 0.2253 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0614 3.0132 -0.8911 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2063 2.5128 0.2658 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4968 2.7799 0.6702 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2360 1.5893 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3585 0.6556 -0.0512 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1194 1.2192 -0.1668 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4793 -0.7374 -0.4761 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3653 -1.4602 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4864 -2.7933 -1.3389 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7265 -3.4245 -1.2945 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8386 -2.7177 -0.8431 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7217 -1.3869 -0.4363 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5254 -3.5678 -0.7877 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.2582 2.5745 2.9471 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9587 -0.2918 -0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5491 -0.9239 -2.0136 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3182 0.1420 -0.8217 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9121 -1.5044 -1.0591 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6173 -1.3940 1.0166 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9019 -3.1836 0.5456 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4433 -3.5068 -0.2419 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0959 -2.8969 -1.1957 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3403 0.4969 0.3533 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 -0.8363 2.3564 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5226 -1.5520 1.4164 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5816 0.2986 2.7017 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9137 1.3816 2.2533 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2678 4.3751 0.0452 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5603 2.8807 -1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8595 3.7188 1.0661 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2857 1.4374 0.6729 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3876 -0.9847 -0.9836 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6149 -3.3368 -1.6935 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8184 -4.4599 -1.6137 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6068 -0.8596 -0.0919 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3203 3.0887 3.5384 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5450 0.0791 -1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5524 -1.2819 -1.1505 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