CT5 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 46 49 0 0 0 0 0 0 0 0999 V2000 2.5424 -0.3959 0.6346 C 0 0 0 0 0 3.3849 0.6635 0.3118 C 0 0 0 0 0 4.4286 0.8887 1.1505 O 0 0 0 0 0 3.8946 2.4727 -1.2116 O 0 0 0 0 0 3.1246 1.4254 -0.8145 C 0 0 0 0 0 2.0213 1.1228 -1.6139 C 0 0 0 0 0 1.1880 0.0756 -1.2971 C 0 0 0 0 0 1.4470 -0.6982 -0.1663 C 0 0 0 0 0 0.5580 -1.8319 0.1818 C 0 0 0 0 0 0.9038 -3.1946 0.1779 C 0 0 0 0 0 2.2521 -3.7588 -0.1897 C 0 0 0 0 0 -0.1400 -3.8897 0.5390 N 0 0 0 0 0 -0.7687 -1.7445 0.5811 C 0 0 0 0 0 -1.2034 -3.0176 0.7988 N 0 0 0 0 0 -1.5604 -0.5069 0.7343 C 0 0 0 0 0 -2.6374 -0.2552 -0.1153 C 0 0 0 0 0 -3.3741 0.9004 0.0319 C 0 0 0 0 0 -4.5377 1.1716 -0.8880 C 0 0 0 0 0 -5.8137 0.5842 -0.2821 C 0 0 0 0 0 -3.0450 1.8185 1.0190 C 0 0 0 0 0 5.3973 1.6869 0.4791 C 0 0 0 0 0 -3.7756 2.9560 1.1574 O 0 0 0 0 0 -1.9790 1.5734 1.8730 C 0 0 0 0 0 4.6831 2.9093 -0.1099 C 0 0 0 0 0 -1.2326 0.4165 1.7352 C 0 0 0 0 0 -0.1853 0.1790 2.5671 O 0 0 0 0 0 2.7432 -0.9911 1.5129 H 0 0 0 0 0 1.8184 1.7200 -2.4911 H 0 0 0 0 0 0.3364 -0.1486 -1.9233 H 0 0 0 0 0 2.2808 -3.9627 -1.2597 H 0 0 0 0 0 3.0284 -3.0378 0.0647 H 0 0 0 0 0 2.4207 -4.6842 0.3601 H 0 0 0 0 0 -2.0946 -3.2741 1.0854 H 0 0 0 0 0 -2.8938 -0.9648 -0.8879 H 0 0 0 0 0 -4.3490 0.7098 -1.8567 H 0 0 0 0 0 -4.6570 2.2474 -1.0146 H 0 0 0 0 0 -6.6551 0.7799 -0.9472 H 0 0 0 0 0 -5.6943 -0.4916 -0.1556 H 0 0 0 0 0 -6.0013 1.0450 0.6865 H 0 0 0 0 0 5.8590 1.1090 -0.3216 H 0 0 0 0 0 6.1609 2.0119 1.1859 H 0 0 0 0 0 -3.3560 3.6260 0.6007 H 0 0 0 0 0 -1.7289 2.2878 2.6438 H 0 0 0 0 0 5.4191 3.6375 -0.4497 H 0 0 0 0 0 4.0400 3.3593 0.6461 H 0 0 0 0 0 0.5962 0.5654 2.1491 H 0 0 0 0 0 1 2 2 0 0 0 1 8 1 0 0 0 1 27 1 0 0 0 2 3 1 0 0 0 2 5 1 0 0 0 3 21 1 0 0 0 4 5 1 0 0 0 4 24 1 0 0 0 5 6 2 0 0 0 6 7 1 0 0 0 6 28 1 0 0 0 7 8 2 0 0 0 7 29 1 0 0 0 8 9 1 0 0 0 9 10 1 0 0 0 9 13 2 0 0 0 10 11 1 0 0 0 10 12 2 0 0 0 11 30 1 0 0 0 11 31 1 0 0 0 11 32 1 0 0 0 12 14 1 0 0 0 13 14 1 0 0 0 13 15 1 0 0 0 14 33 1 0 0 0 15 16 2 0 0 0 15 25 1 0 0 0 16 17 1 0 0 0 16 34 1 0 0 0 17 18 1 0 0 0 17 20 2 0 0 0 18 19 1 0 0 0 18 35 1 0 0 0 18 36 1 0 0 0 19 37 1 0 0 0 19 38 1 0 0 0 19 39 1 0 0 0 20 22 1 0 0 0 20 23 1 0 0 0 21 24 1 0 0 0 21 40 1 0 0 0 21 41 1 0 0 0 22 42 1 0 0 0 23 25 2 0 0 0 23 43 1 0 0 0 24 44 1 0 0 0 24 45 1 0 0 0 25 26 1 0 0 0 26 46 1 0 0 0 M END $$$$