BV7E1Q -OEChem-04042101363D 36 37 0 0 0 0 0 0 0999 V2000 7.3784 2.0033 0.3318 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.3175 -0.3660 -0.5440 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8344 -1.7182 -0.3572 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5669 0.3284 -1.8021 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3203 1.2793 -1.1511 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5974 -0.5769 0.0891 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8181 0.5573 0.7113 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6142 1.5943 1.9259 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0450 0.3520 0.0609 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5826 -0.4278 -0.3581 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1897 -0.5267 -0.0616 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 0.5372 -0.9683 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -1.4420 0.4004 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3949 0.4878 -0.8199 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 -1.4916 0.5487 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9427 -0.0031 -0.0857 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5631 0.2912 -0.4393 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8881 1.0219 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3204 -1.3110 0.2188 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2113 0.7392 0.2887 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6434 -1.5938 0.5581 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5888 -0.5686 0.5932 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0790 0.8339 0.9114 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2148 1.3411 -1.5564 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6031 -2.1997 0.8903 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1578 1.2703 -1.3199 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1696 -2.2866 1.1435 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9064 -1.3278 0.6999 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6001 2.0451 -0.2821 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6317 -2.1488 0.1666 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9401 -2.6134 0.7863 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6166 -0.8042 0.8575 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6130 1.7541 1.9985 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0213 2.0173 2.6317 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0245 0.5665 0.2156 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8347 -0.2270 -0.7435 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 7 1 0 0 0 0 2 10 1 0 0 0 0 5 17 2 0 0 0 0 6 11 1 0 0 0 0 6 17 1 0 0 0 0 6 28 1 0 0 0 0 7 23 2 0 0 0 0 8 23 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 23 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 13 15 2 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 19 21 2 0 0 0 0 19 30 1 0 0 0 0 20 22 2 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 22 32 1 0 0 0 0 M END $$$$