B1DXS3 -OEChem-04022115273D 40 40 0 1 0 0 0 0 0999 V2000 5.2093 -1.7804 0.2262 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.1782 -0.1013 1.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1859 -0.3521 -0.5466 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1355 0.9473 -0.4014 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1465 2.4208 0.1005 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3118 -1.1345 -0.0934 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1998 0.1048 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2138 0.2592 -0.2439 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8903 3.2672 -0.6541 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5236 3.0770 -0.0747 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0729 -0.3514 0.9827 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 -2.4558 0.4905 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2429 -1.4162 -1.2783 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0281 0.5630 0.8471 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6355 -0.6749 -1.1901 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2641 -0.0670 0.9918 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8715 -1.3050 -1.0455 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6857 -1.0009 0.0454 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3635 0.9780 -1.4762 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0733 2.4690 1.1732 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 -0.1393 -1.5375 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9158 2.9328 -0.4789 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8398 4.3133 -0.3316 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7069 3.2436 -1.7341 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2841 2.5741 0.5308 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4995 4.1254 0.2418 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8463 3.0468 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0069 -0.8631 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3358 0.6526 0.6291 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5137 -0.2360 1.9154 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6378 -3.1102 0.7618 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 -2.9945 -0.2368 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1984 -2.3215 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1105 -2.0115 -0.9731 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7201 -1.9659 -2.0698 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -0.4837 -1.7204 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7286 1.2626 1.6197 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0092 -0.9221 -2.0432 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8858 0.1749 1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1867 -2.0315 -1.7901 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 7 2 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 19 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 20 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 16 1 0 0 0 0 14 37 1 0 0 0 0 15 17 2 0 0 0 0 15 38 1 0 0 0 0 16 18 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 M END $$$$