BB6QI0 -OEChem-04022105582D 42 44 0 0 0 0 0 0 0999 V2000 7.0444 -0.5367 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.1703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5984 1.6110 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6235 -0.4135 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8209 2.5859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3802 0.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0435 3.5608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 2.8084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7959 2.3634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6235 1.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3802 -0.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1896 0.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5984 -0.6360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2742 1.5221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2742 -0.5472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8209 -1.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1803 1.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1803 -0.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0879 -2.2911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7765 -1.9057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3104 -3.2660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 -2.8806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 -3.5608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6479 3.4228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1814 4.1653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4390 3.6988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 3.4129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2416 2.9464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 2.2040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6579 1.7589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4003 2.2254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9338 2.9678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7049 0.8740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7049 0.1009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 2.1421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 -1.1672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 1.3204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4954 -2.1084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2310 -1.4840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8559 -3.6878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5915 -3.0634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4039 -4.1653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 10 2 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 10 1 0 0 0 0 4 12 1 0 0 0 0 4 13 2 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 11 2 0 0 0 0 6 14 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 12 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 16 1 0 0 0 0 14 17 2 0 0 0 0 14 35 1 0 0 0 0 15 18 2 0 0 0 0 15 36 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 19 21 1 0 0 0 0 19 38 1 0 0 0 0 20 22 2 0 0 0 0 20 39 1 0 0 0 0 21 23 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 M END $$$$