BKO4Z1 -OEChem-04012115022D 47 51 0 0 0 0 0 0 0999 V2000 6.3758 3.0291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.6499 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7094 1.4459 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3701 2.9229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.9596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 1.9101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 0.1548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.1548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 2.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.8452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5048 0.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4892 1.5361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6076 -0.8617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5763 1.9444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5920 0.5414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3148 0.7194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2992 2.1224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7976 -1.4480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9004 -2.4428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2120 1.7141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5204 -1.2700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8132 -2.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6233 -2.2647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0904 -3.0291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 2.5297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 1.9974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 0.1548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -1.2392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.4652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.9648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.6552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0897 0.1778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8808 0.4663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2354 2.7392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2316 -1.1949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7142 2.0777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0227 -0.9064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8770 -3.4678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1892 -2.5178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7268 -2.5269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5881 -3.3927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4539 -3.5314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 11 1 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 2 32 1 0 0 0 0 3 11 2 0 0 0 0 3 17 1 0 0 0 0 4 17 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 2 0 0 0 0 6 8 1 0 0 0 0 6 10 2 0 0 0 0 7 11 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 12 2 0 0 0 0 9 31 1 0 0 0 0 10 15 1 0 0 0 0 10 33 1 0 0 0 0 12 18 1 0 0 0 0 12 34 1 0 0 0 0 13 16 1 0 0 0 0 13 19 2 0 0 0 0 13 20 1 0 0 0 0 14 17 1 0 0 0 0 14 19 1 0 0 0 0 14 21 2 0 0 0 0 15 18 2 0 0 0 0 15 35 1 0 0 0 0 16 22 1 0 0 0 0 16 25 2 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 24 2 0 0 0 0 20 38 1 0 0 0 0 21 24 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 26 1 0 0 0 0 23 28 1 0 0 0 0 24 41 1 0 0 0 0 25 27 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 M END $$$$