BL6KS3 -OEChem-04012116572D 39 41 0 1 0 0 0 0 0999 V2000 9.0687 0.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 0.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4809 -0.3760 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5836 1.2377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5836 -0.3717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4809 1.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0687 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0687 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5687 -0.4330 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5687 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5687 1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5687 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0687 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5687 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5687 1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0687 -1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0687 -1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5391 0.8477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5391 0.0183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8346 1.8046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0462 1.5470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0462 -0.6809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8346 -0.9386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6725 1.8317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8787 0.1039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1513 -0.2210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4610 0.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2587 -0.9699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2587 1.8360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8787 -0.9699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8787 1.8360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5317 -0.9890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7587 -1.8360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6056 -1.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5317 -1.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3787 -1.8360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6056 -0.9890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 15 1 0 0 0 0 2 5 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 3 7 2 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 11 18 1 0 0 0 0 11 27 1 0 0 0 0 12 16 1 0 0 0 0 12 30 1 0 0 0 0 13 17 2 0 0 0 0 13 31 1 0 0 0 0 14 19 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 M END $$$$