RDKit 3D 49 52 0 0 0 0 0 0 0 0999 V2000 5.7707 0.9262 -0.4862 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5066 1.1833 -1.0821 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8996 0.0171 -1.6465 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0549 -0.7167 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6689 -0.1032 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1756 0.5793 -1.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0149 -0.3957 0.7621 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1611 -1.7562 1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2034 -2.7566 0.6362 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1553 -2.1481 0.4961 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4073 -2.7428 0.1881 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 -4.0544 -0.1009 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1849 -4.2969 -0.3605 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1112 -3.2569 -0.3327 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7161 -1.9469 -0.0455 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3585 -1.7193 0.2102 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7013 -0.5481 0.5219 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3614 -0.7884 0.6647 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3066 0.2101 1.0640 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5078 1.6695 0.6769 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1327 2.0605 -0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2792 3.4093 -0.8495 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7858 4.3794 0.0286 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1581 4.0323 1.2217 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0165 2.6759 1.5354 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4227 5.1866 2.3654 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9579 5.7655 -0.3356 N 0 0 0 0 0 4 0 0 0 0 0 0 -2.1220 6.1871 -0.3822 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0585 6.4162 -0.6080 O 0 0 0 0 0 1 0 0 0 0 0 0 5.6859 0.1856 0.3138 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1435 1.8601 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4841 0.5831 -1.2415 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2988 0.3418 -2.5019 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6763 -0.6493 -2.0411 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9085 -1.7502 -0.9409 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5662 -0.7111 0.3592 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1874 -2.1222 1.2563 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9299 -1.6903 2.4038 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5844 -2.9953 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1584 -3.6873 1.2115 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1175 -4.8722 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5150 -5.3077 -0.5868 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1588 -3.4659 -0.5379 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4416 -1.1403 -0.0246 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1534 0.3513 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3555 0.2103 2.1652 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4623 1.3083 -1.2391 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7509 3.6895 -1.7888 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4885 2.3932 2.4584 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 2 0 5 7 1 0 7 8 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 15 16 2 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 24 26 1 0 23 27 1 0 27 28 2 0 27 29 1 0 19 7 1 0 18 10 2 0 16 11 1 0 25 20 1 0 1 30 1 0 1 31 1 0 1 32 1 0 3 33 1 0 3 34 1 0 4 35 1 0 4 36 1 0 8 37 1 0 8 38 1 0 9 39 1 0 9 40 1 0 12 41 1 0 13 42 1 0 14 43 1 0 15 44 1 0 17 45 1 0 19 46 1 1 21 47 1 0 22 48 1 0 25 49 1 0 M CHG 2 27 1 29 -1 M END