B80HFZ -OEChem-04042102083D 35 37 0 0 0 0 0 0 0999 V2000 4.1842 0.2694 1.5151 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.1794 1.5250 -0.9012 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.2964 1.3960 -1.8183 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9952 2.7577 -0.1594 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7296 1.1103 -1.7293 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4275 -1.4250 -1.5982 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4532 0.8603 -0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0047 -0.4172 -0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1703 -0.6112 -0.1464 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1736 1.7307 0.4913 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0257 1.9290 -0.2656 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7463 0.4635 0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 0.2061 0.2705 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7259 -1.8971 -0.1028 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7476 2.9053 1.2168 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7382 0.3275 1.5316 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -0.9560 -0.0683 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1333 -2.9375 -0.8037 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9951 -2.6509 -1.5298 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8473 -0.7134 2.4539 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1241 -1.9969 0.8538 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5402 -1.8755 2.1149 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8447 0.4891 -2.5411 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5873 2.9211 -0.3346 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6212 -2.1278 0.4671 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7577 2.7252 2.2969 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7644 3.1154 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1597 3.8152 1.0516 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1954 1.2233 1.8188 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4697 -1.0756 -1.0474 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5489 -3.9380 -0.7812 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4878 -3.4244 -2.0971 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3923 -0.6192 3.4355 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6614 -2.9029 0.5893 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6244 -2.6864 2.8325 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 2 13 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 6 8 1 0 0 0 0 6 19 2 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 12 2 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 11 24 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 18 2 0 0 0 0 14 25 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 20 1 0 0 0 0 16 29 1 0 0 0 0 17 21 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 20 22 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 M END $$$$