CUB Converted by convert_cif2sdf.py 2024/03/29 11:09:15 20 21 0 0 0 0 0 0 0 0999 V2000 100.6932 141.5472 145.9360 C 0 0 0 0 0 100.0421 141.9551 144.8111 C 0 0 0 0 0 99.1401 143.0177 144.8918 C 0 0 0 0 0 98.1538 142.7606 145.9224 N 0 0 0 0 0 97.6693 144.0516 147.1070 CU 0 3 0 0 0 95.7246 139.8280 145.0635 MO 0 0 0 0 0 96.1105 141.3475 146.8220 S 0 0 0 0 0 97.2683 141.8221 145.6539 C 0 0 0 0 0 97.1886 141.0924 144.6125 O 0 0 0 0 0 101.9729 140.5893 145.7886 C 0 0 0 0 0 96.4441 138.3524 145.3086 O 0 0 0 0 0 100.9823 142.4463 146.5287 H 0 0 0 0 0 99.9579 141.0629 146.6207 H 0 0 0 0 0 100.7973 142.1880 144.0250 H 0 0 0 0 0 99.5205 141.0781 144.3623 H 0 0 0 0 0 99.6578 143.9931 145.0456 H 0 0 0 0 0 98.6644 143.2371 143.9072 H 0 0 0 0 0 102.5056 140.2558 146.7096 H 0 0 0 0 0 101.6828 139.6911 145.1954 H 0 0 0 0 0 102.7068 141.0745 145.1043 H 0 0 0 0 0 1 2 1 0 0 0 1 10 1 0 0 0 1 12 1 0 0 0 1 13 1 0 0 0 2 3 1 0 0 0 2 14 1 0 0 0 2 15 1 0 0 0 3 4 1 0 0 0 3 16 1 0 0 0 3 17 1 0 0 0 4 5 1 0 0 0 4 8 1 0 0 0 6 7 1 0 0 0 6 8 1 0 0 0 6 9 1 0 0 0 6 11 2 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 10 18 1 0 0 0 10 19 1 0 0 0 10 20 1 0 0 0 M END $$$$