J45 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 29 30 0 0 0 0 0 0 0 0999 V2000 3.5325 -1.9311 0.2254 N 0 0 0 0 0 2.2529 -2.1767 0.4215 C 0 0 0 0 0 1.3389 -1.2342 0.3137 N 0 0 0 0 0 1.6823 0.0122 -0.0002 C 0 0 0 0 0 3.0289 0.3084 -0.2153 C 0 0 0 0 0 3.9532 -0.7124 -0.0908 C 0 0 0 0 0 0.7168 1.0020 -0.1132 N 0 0 0 0 0 -0.6378 0.6707 -0.0108 C 0 0 0 0 0 -1.5338 1.5741 0.5450 C 0 0 0 0 0 -2.8717 1.2453 0.6442 C 0 0 0 0 0 -3.3187 0.0173 0.1904 C 0 0 0 0 0 -2.4287 -0.8840 -0.3633 C 0 0 0 0 0 -1.0911 -0.5592 -0.4711 C 0 0 0 0 0 -5.0261 -0.3985 0.3196 S 0 0 0 0 0 -5.0941 -1.8181 0.3155 O 0 0 0 0 0 -5.5564 0.4023 1.3659 O 0 0 0 0 0 -5.7611 0.1083 -1.0754 N 0 0 0 0 0 3.4571 1.6808 -0.5670 N 0 3 0 0 0 3.7466 2.4726 0.3124 O 0 5 0 0 0 3.5204 2.0185 -1.7354 O 0 0 0 0 0 5.6430 -0.4047 -0.3446 CL 0 0 0 0 0 1.9450 -3.1797 0.6778 H 0 0 0 0 0 0.9812 1.9221 -0.2639 H 0 0 0 0 0 -1.1855 2.5326 0.8993 H 0 0 0 0 0 -3.5698 1.9473 1.0765 H 0 0 0 0 0 -2.7809 -1.8425 -0.7154 H 0 0 0 0 0 -0.3963 -1.2618 -0.9082 H 0 0 0 0 0 -5.2392 0.5448 -1.7673 H 0 0 0 0 0 -6.7119 -0.0305 -1.2001 H 0 0 0 0 0 1 2 2 0 0 0 1 6 1 0 0 0 2 3 1 0 0 0 3 4 2 0 0 0 4 5 1 0 0 0 4 7 1 0 0 0 5 6 2 0 0 0 5 18 1 0 0 0 6 21 1 0 0 0 7 8 1 0 0 0 8 9 2 0 0 0 8 13 1 0 0 0 9 10 1 0 0 0 10 11 2 0 0 0 11 12 1 0 0 0 11 14 1 0 0 0 12 13 2 0 0 0 14 15 2 0 0 0 14 16 2 0 0 0 14 17 1 0 0 0 18 19 1 0 0 0 18 20 2 0 0 0 2 22 1 0 0 0 7 23 1 0 0 0 9 24 1 0 0 0 10 25 1 0 0 0 12 26 1 0 0 0 13 27 1 0 0 0 17 28 1 0 0 0 17 29 1 0 0 0 M END $$$$