BA4D2M -OEChem-04012114262D 57 58 0 1 0 0 0 0 0999 V2000 0.0000 0.6200 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.2392 9.4121 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 5.6200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3776 5.2133 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.2798 4.5952 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 4.1200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7445 2.9480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5366 3.9261 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5856 4.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0014 2.2788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6956 2.6389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 5.6200 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2093 1.3007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9035 1.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0468 5.9564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5686 6.6145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1604 0.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5468 6.8224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 5.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 3.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 2.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 2.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 2.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 1.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 1.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 0.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1549 3.1395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1263 3.7345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9659 4.2135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4993 3.6212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6728 2.8046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4265 2.0466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3152 2.6606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7819 3.2529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4966 5.0008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5897 1.2790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1230 0.6867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2320 1.1350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4784 1.8930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4616 5.4957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5484 6.3208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5038 7.2311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9486 6.6145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8693 0.4442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6489 0.6099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1132 7.0746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3552 7.4121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8694 4.4036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1509 5.2017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 4.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1215 3.5123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3291 2.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 2.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2392 9.4121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 57 1 0 0 0 0 3 19 2 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 4 15 1 0 0 0 0 8 5 1 6 0 0 0 5 48 1 0 0 0 0 5 49 1 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 6 50 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 13 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 14 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 16 1 0 0 0 0 12 19 1 6 0 0 0 12 35 1 0 0 0 0 13 17 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 17 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 18 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 18 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 53 1 0 0 0 0 23 25 2 0 0 0 0 23 54 1 0 0 0 0 24 26 2 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 26 56 1 0 0 0 0 M END $$$$