B5RJD2 -OEChem-04022112423D 26 27 0 0 0 0 0 0 0999 V2000 -2.4804 0.5729 -2.5258 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6044 0.9179 0.1660 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5319 -1.7095 0.0388 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 2.7626 0.2233 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2543 0.4450 0.1029 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3462 0.5002 0.2159 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6145 -0.7441 0.0371 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1233 0.3589 -0.9338 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9209 0.3149 1.4733 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -1.9661 -0.0748 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1324 -0.6816 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6048 0.4037 0.0539 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6478 -1.9679 -0.1221 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4751 0.0325 -0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2727 -0.0116 1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3416 -0.7645 -0.0573 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0499 -0.1528 0.4315 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2773 1.6894 0.1244 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3352 0.4192 2.3837 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7167 -2.9046 -0.1256 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1891 -2.9051 -0.2096 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0963 -0.0819 -1.7109 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7203 -0.1561 2.5599 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4258 -0.7577 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1024 -0.4071 0.5157 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3797 1.6741 0.0854 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 2 6 1 0 0 0 0 2 11 1 0 0 0 0 3 11 2 0 0 0 0 4 18 2 0 0 0 0 5 7 1 0 0 0 0 5 12 2 0 0 0 0 6 8 1 0 0 0 0 6 9 2 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 8 14 2 0 0 0 0 9 15 1 0 0 0 0 9 19 1 0 0 0 0 10 13 1 0 0 0 0 10 20 1 0 0 0 0 12 16 1 0 0 0 0 12 18 1 0 0 0 0 13 16 2 0 0 0 0 13 21 1 0 0 0 0 14 17 1 0 0 0 0 14 22 1 0 0 0 0 15 17 2 0 0 0 0 15 23 1 0 0 0 0 16 24 1 0 0 0 0 17 25 1 0 0 0 0 18 26 1 0 0 0 0 M END $$$$