IU Converted by convert_cif2sdf.py 2024/03/01 05:07:52 34 35 0 0 0 0 0 0 0 0999 V2000 -2.4426 2.5199 -1.5058 P 0 0 0 0 0 -3.0106 3.3262 -2.6370 O 0 0 0 0 0 -1.6308 3.3663 -0.3927 O 0 0 0 0 0 -3.5344 1.7079 -0.6311 O 0 0 0 0 0 -1.3989 1.3636 -1.9468 O 0 0 0 0 0 -0.8184 0.5568 -0.9377 C 0 0 0 0 0 0.1192 -0.4472 -1.5960 C 0 0 0 0 0 1.1722 0.2866 -2.2581 O 0 0 0 0 0 0.8135 -1.3660 -0.5986 C 0 0 0 0 0 1.2032 -2.5517 -1.2914 O 0 0 0 0 0 2.0333 -0.5552 -0.2172 C 0 0 0 0 0 3.0736 -1.3612 0.2978 O 0 0 0 0 0 2.4015 0.1021 -1.5362 C 0 0 0 0 0 3.0327 1.3779 -1.3562 N 0 0 0 0 0 4.4390 1.5011 -1.3221 C 0 0 0 0 0 5.2126 0.5493 -1.4400 O 0 0 0 0 0 4.9169 2.8036 -1.1408 N 0 0 0 0 0 4.1639 3.9607 -0.9940 C 0 0 0 0 0 4.6673 5.0696 -0.8372 O 0 0 0 0 0 2.6918 3.7481 -1.0396 C 0 0 0 0 0 2.2281 2.5043 -1.2142 C 0 0 0 0 0 1.4387 5.3550 -0.8372 I 0 0 0 0 0 -2.0402 4.1751 -0.0195 H 0 0 0 0 0 -4.3366 2.1767 -0.3189 H 0 0 0 0 0 -0.2613 1.1921 -0.2465 H 0 0 0 0 0 -1.6080 0.0334 -0.3969 H 0 0 0 0 0 -0.4281 -1.0063 -2.3617 H 0 0 0 0 0 0.1937 -1.6633 0.2512 H 0 0 0 0 0 1.1414 -2.3488 -2.2373 H 0 0 0 0 0 1.7663 0.1951 0.5367 H 0 0 0 0 0 3.8702 -0.8041 0.3482 H 0 0 0 0 0 3.0765 -0.5137 -2.1385 H 0 0 0 0 0 5.9271 2.9149 -1.1137 H 0 0 0 0 0 1.1624 2.2982 -1.2539 H 0 0 0 0 0 1 2 2 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 1 5 1 0 0 0 3 23 1 0 0 0 4 24 1 0 0 0 5 6 1 0 0 0 6 7 1 0 0 0 6 25 1 0 0 0 6 26 1 0 0 0 7 8 1 0 0 0 7 9 1 0 0 0 7 27 1 0 0 0 8 13 1 0 0 0 9 10 1 0 0 0 9 11 1 0 0 0 9 28 1 0 0 0 10 29 1 0 0 0 11 12 1 0 0 0 11 13 1 0 0 0 11 30 1 0 0 0 12 31 1 0 0 0 13 14 1 0 0 0 13 32 1 0 0 0 14 15 1 0 0 0 14 21 1 0 0 0 15 16 2 0 0 0 15 17 1 0 0 0 17 18 1 0 0 0 17 33 1 0 0 0 18 19 2 0 0 0 18 20 1 0 0 0 20 21 2 0 0 0 20 22 1 0 0 0 21 34 1 0 0 0 M END $$$$