BGI90S -OEChem-04022117303D 49 52 0 1 0 0 0 0 0999 V2000 -0.4357 -3.1288 -1.9666 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5922 -3.4540 1.3129 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0657 3.6199 0.8915 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7697 -0.9073 0.5714 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5645 3.6674 -0.7243 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8050 1.5613 -0.4831 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8279 -0.9828 0.2469 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5839 2.3571 0.0775 N 0 0 2 0 0 0 0 0 0 0 0 0 0.8418 1.3179 0.0702 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3536 2.2522 1.1845 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6303 1.5735 -1.2257 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8751 2.1193 1.3464 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1354 1.4365 -0.9751 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6704 1.3626 -0.0718 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4391 0.2272 0.1886 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0299 2.2499 0.2706 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2958 2.5467 -0.4653 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8254 0.2786 0.0556 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6842 2.5960 -0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4545 1.4620 -0.3379 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6089 -0.9333 0.3366 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5032 -2.0538 0.8355 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8399 -2.1271 0.7425 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9137 -3.1109 0.4245 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9687 -2.9750 -0.9681 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0881 -2.9741 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1817 -2.7057 -1.6022 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3009 -2.7049 0.5387 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3478 -2.5708 -0.8488 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1304 0.3076 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8593 2.0098 2.1331 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4266 2.5663 -1.6417 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3256 0.8491 -1.9914 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2156 2.8559 2.0849 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1134 1.1215 1.7376 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3747 0.3997 -0.7113 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6582 1.6617 -1.9127 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3301 1.2482 0.5989 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3738 2.9752 1.0163 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5606 2.4816 -0.6595 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3737 4.1533 1.6438 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1648 3.5221 -0.9051 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1653 4.3875 -0.9818 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3993 -3.0325 0.9525 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0355 2.4638 -0.7621 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0783 -3.0726 2.2563 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2369 -2.5960 -2.6823 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2088 -2.5976 1.1252 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2918 -2.3591 -1.3421 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 22 1 0 0 0 0 2 24 1 0 0 0 0 3 10 1 0 0 0 0 3 41 1 0 0 0 0 4 15 1 0 0 0 0 4 22 1 0 0 0 0 5 17 1 0 0 0 0 5 43 1 0 0 0 0 6 20 1 0 0 0 0 6 45 1 0 0 0 0 7 21 2 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 9 30 1 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 17 2 0 0 0 0 15 18 2 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 21 23 1 0 0 0 0 22 23 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 27 2 0 0 0 0 26 28 1 0 0 0 0 26 46 1 0 0 0 0 27 29 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 M END $$$$