BVXM96 -OEChem-04042103193D 40 41 0 0 0 0 0 0 0999 V2000 -5.9058 -0.1678 -0.0259 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 -1.5570 0.0371 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7626 2.1659 -0.0248 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4127 2.9190 -0.0218 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9845 -3.3165 0.5728 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -0.8304 0.0401 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4390 0.8457 0.0143 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0309 -0.5082 0.0119 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9504 0.5800 0.0037 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6721 -1.7273 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4028 -0.4256 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2595 0.1512 0.0161 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5971 1.9785 -0.0149 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1061 -0.3716 1.2064 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0922 -0.4002 -1.2094 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1271 -3.0492 0.0429 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4986 -0.2917 1.1975 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4846 -0.3203 -1.2185 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -4.2249 -0.5975 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1879 -0.2660 -0.0149 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7666 0.3484 0.0277 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2396 3.5157 -0.0439 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7978 1.4488 0.0202 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7534 3.5036 -0.0522 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5841 -0.3896 2.1603 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5591 -0.4408 -2.1564 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3370 1.8580 0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0334 -0.2495 2.1428 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0085 -0.3005 -2.1707 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7002 -4.5421 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -3.9375 -1.5816 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1938 -5.0640 -0.7333 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8765 4.0413 0.8459 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8665 4.0196 -0.9421 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7975 1.0218 0.1378 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7476 1.9897 -0.9288 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6094 2.1412 0.8455 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1302 2.9653 -0.9278 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1400 2.9866 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1517 4.5219 -0.0667 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 10 1 0 0 0 0 2 12 1 0 0 0 0 3 13 1 0 0 0 0 3 22 1 0 0 0 0 4 13 2 0 0 0 0 5 16 2 0 0 0 0 6 21 2 0 0 0 0 7 12 1 0 0 0 0 7 21 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 16 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 14 17 1 0 0 0 0 14 25 1 0 0 0 0 15 18 2 0 0 0 0 15 26 1 0 0 0 0 16 19 1 0 0 0 0 17 20 2 0 0 0 0 17 28 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 M END $$$$