RDKit 3D 49 52 0 0 0 0 0 0 0 0999 V2000 2.2351 0.6391 1.2347 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2129 0.7015 -0.2513 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4178 1.8578 -0.7469 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0373 1.7303 -0.4238 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6147 0.3738 -0.6221 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2774 -0.7670 -0.3276 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3386 -2.0107 -0.9871 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5876 -2.3666 -0.2318 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3455 -1.1949 0.2186 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5774 -1.4052 0.7058 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3990 -0.2945 1.1754 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3149 -0.5090 1.9817 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1196 1.0600 0.6786 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0013 1.0750 -0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 0.2030 0.1885 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6124 0.6040 1.6428 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6507 -0.5789 -0.8787 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6656 -1.5750 -0.4505 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9883 -0.8083 -0.5056 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6146 0.6475 -0.8006 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4750 1.5249 -0.1852 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -0.3495 1.6561 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2762 0.9183 1.5738 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5835 1.4055 1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5884 2.0310 -1.8426 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7961 2.7797 -0.2494 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5852 2.4403 -1.0908 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2457 2.0807 0.6121 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9399 0.2787 -1.7005 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3525 -1.0064 0.7339 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -2.8253 -1.0549 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6388 -1.6895 -2.0081 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2182 -3.0867 -0.7915 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2618 -2.9202 0.6963 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9540 -2.4211 0.7445 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0693 1.4586 0.2311 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8941 1.7086 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3893 0.5888 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6728 2.1101 -0.4837 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8693 1.6732 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2502 0.0200 2.3377 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5741 0.3805 1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6866 -0.4762 -1.9721 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7387 -2.4539 -1.1385 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4994 -2.0063 0.5578 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6036 -1.2036 -1.3371 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 -0.8324 0.4588 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5456 0.7921 -1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2390 1.6983 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 1 6 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 17 2 1 0 20 2 1 0 15 5 1 0 15 9 1 0 1 22 1 0 1 23 1 0 1 24 1 0 3 25 1 0 3 26 1 0 4 27 1 0 4 28 1 0 5 29 1 6 6 30 1 1 7 31 1 0 7 32 1 0 8 33 1 0 8 34 1 0 10 35 1 0 13 36 1 0 13 37 1 0 14 38 1 0 14 39 1 0 16 40 1 0 16 41 1 0 16 42 1 0 17 43 1 6 18 44 1 0 18 45 1 0 19 46 1 0 19 47 1 0 20 48 1 6 21 49 1 0 M END