BKSW27 -OEChem-04022105102D 44 47 0 1 0 0 0 0 0999 V2000 6.7071 -2.3444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 1.4784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9579 -0.5471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9579 1.5222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 1.4784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4659 -0.5125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -0.2537 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2412 -1.2196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2071 -1.4784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 0.6124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3320 -0.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 1.4784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 0.6124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1980 -0.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3320 0.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0640 -0.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 1.4784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0640 0.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 2.3444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1980 1.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 2.3444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8640 -0.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8640 1.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 2.3444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.3444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0174 0.4207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6423 -1.0591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0807 -1.8184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 0.0754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1980 -1.1325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7950 1.2975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1980 2.1075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3100 2.8814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 2.8814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0731 -0.6170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4749 0.0728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4749 0.9023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0731 1.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5369 2.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3100 2.8814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4631 2.6544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 2.6544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 2.8814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 2 0 0 0 0 2 12 1 0 0 0 0 2 24 1 0 0 0 0 3 16 1 0 0 0 0 3 22 1 0 0 0 0 4 18 1 0 0 0 0 4 23 1 0 0 0 0 5 17 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 26 1 6 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 19 1 0 0 0 0 13 17 2 0 0 0 0 13 29 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 15 20 2 0 0 0 0 15 31 1 0 0 0 0 16 18 2 0 0 0 0 17 21 1 0 0 0 0 18 20 1 0 0 0 0 19 21 2 0 0 0 0 19 33 1 0 0 0 0 20 32 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END $$$$