B4BN2A -OEChem-04012114572D 44 47 0 1 0 0 0 0 0999 V2000 5.6500 0.4084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9061 -2.6678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1783 -0.5914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9219 2.4019 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4501 0.4153 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4420 -0.6263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5320 -1.1332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5480 0.9361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6660 -0.6332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 -1.1332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3180 0.9119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -2.1540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 -2.1332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5320 -2.1332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9061 -0.5985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6660 -2.6332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1821 0.4086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3219 1.9119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5033 -3.0219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0501 0.9053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1898 2.4086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0539 1.9053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1837 -0.0140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6466 -1.2116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0537 -0.5249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9453 1.4121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1470 1.4090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0690 -2.4432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9132 0.0215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6660 -3.2532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4643 -0.8003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7862 2.2240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9976 -1.5378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -2.1602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0024 -2.7778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9652 -2.7140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1954 -3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0415 -3.3298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5858 0.5932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1922 3.0286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7140 -0.9034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9243 3.0219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 3 18 1 0 0 0 0 3 43 1 0 0 0 0 4 24 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 5 25 1 6 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 9 2 0 0 0 0 7 14 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 10 13 2 0 0 0 0 10 15 1 0 0 0 0 11 18 2 0 0 0 0 11 19 1 0 0 0 0 12 17 1 0 0 0 0 12 20 1 0 0 0 0 12 21 1 0 0 0 0 13 16 1 0 0 0 0 14 16 2 0 0 0 0 14 30 1 0 0 0 0 15 17 2 0 0 0 0 15 31 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 18 22 1 0 0 0 0 19 23 2 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 24 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 M END $$$$