CWU Converted by convert_cif2sdf.py 2024/03/29 11:09:15 39 42 0 0 0 0 0 0 0 0999 V2000 3.1905 2.8202 -0.7077 C 0 0 0 0 0 1.8509 2.7504 -0.3741 C 0 0 0 0 0 3.9397 1.6645 -0.7965 C 0 0 0 0 0 1.2645 1.5242 -0.1294 C 0 0 0 0 0 -0.8477 0.6791 1.6199 C 0 0 0 0 0 -2.0615 1.3137 1.4076 C 0 0 0 0 0 -1.5304 -1.1191 0.1789 C 0 0 0 0 0 3.3547 0.4334 -0.5517 C 0 0 0 0 0 2.0152 0.3626 -0.2172 C 0 0 0 0 0 -0.5769 -0.5273 1.0140 C 0 0 0 0 0 -3.0155 0.7409 0.5834 C 0 0 0 0 0 -2.7567 -0.4785 -0.0365 C 0 0 0 0 0 -1.2441 -2.4097 -0.4727 C 0 0 0 0 0 3.9475 -0.9586 -0.5817 C 0 0 0 0 0 -4.6015 0.3838 -0.9471 C 0 0 0 0 0 1.6169 -1.0810 -0.0005 C 0 0 0 0 0 2.9457 -1.8423 0.1914 C 0 0 0 0 0 0.7458 -1.2096 1.2505 C 0 0 0 0 0 -0.6600 -2.4384 -1.6862 O 0 0 0 0 0 -1.5359 -3.4497 0.0845 O 0 0 0 0 0 -4.2637 1.1576 0.2200 O 0 0 0 0 0 -3.8381 -0.8269 -0.7866 O 0 0 0 0 0 3.2938 -1.9143 1.5749 O 0 0 0 0 0 3.6490 3.7781 -0.9033 H 0 0 0 0 0 1.2634 3.6536 -0.3042 H 0 0 0 0 0 4.9867 1.7193 -1.0581 H 0 0 0 0 0 0.2176 1.4694 0.1312 H 0 0 0 0 0 -0.1086 1.1364 2.2614 H 0 0 0 0 0 -2.2642 2.2590 1.8876 H 0 0 0 0 0 4.0435 -1.3066 -1.6102 H 0 0 0 0 0 4.9188 -0.9666 -0.0871 H 0 0 0 0 0 1.0856 -1.4622 -0.8732 H 0 0 0 0 0 1.2503 -0.7403 2.0949 H 0 0 0 0 0 0.5765 -2.2636 1.4688 H 0 0 0 0 0 -0.4922 -3.3077 -2.0736 H 0 0 0 0 0 2.8884 -2.8384 -0.2476 H 0 0 0 0 0 -5.6689 0.1648 -0.9658 H 0 0 0 0 0 -4.3013 0.9084 -1.8540 H 0 0 0 0 0 4.1612 -2.3077 1.7420 H 0 0 0 0 0 1 2 1 0 0 0 1 3 2 0 0 0 2 4 2 0 0 0 3 8 1 0 0 0 4 9 1 0 0 0 5 6 1 0 0 0 5 10 2 0 0 0 6 11 2 0 0 0 7 10 1 0 0 0 7 12 2 0 0 0 7 13 1 0 0 0 8 9 2 0 0 0 8 14 1 0 0 0 9 16 1 0 0 0 10 18 1 0 0 0 11 12 1 0 0 0 11 21 1 0 0 0 12 22 1 0 0 0 13 19 1 0 0 0 13 20 2 0 0 0 14 17 1 0 0 0 15 21 1 0 0 0 15 22 1 0 0 0 16 17 1 0 0 0 16 18 1 0 0 0 17 23 1 0 0 0 1 24 1 0 0 0 2 25 1 0 0 0 3 26 1 0 0 0 4 27 1 0 0 0 5 28 1 0 0 0 6 29 1 0 0 0 14 30 1 0 0 0 14 31 1 0 0 0 16 32 1 0 0 0 18 33 1 0 0 0 18 34 1 0 0 0 19 35 1 0 0 0 17 36 1 0 0 0 15 37 1 0 0 0 15 38 1 0 0 0 23 39 1 0 0 0 M END $$$$