BEIR54 -OEChem-04042106013D 49 52 0 1 0 0 0 0 0999 V2000 5.7472 -0.6761 1.4738 F 0 0 0 0 0 0 0 0 0 0 0 0 4.0576 0.3128 2.4262 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5192 2.6299 -0.3335 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.8454 0.8889 -1.5199 F 0 0 0 0 0 0 0 0 0 0 0 0 -8.7487 -0.9374 -0.7600 F 0 0 0 0 0 0 0 0 0 0 0 0 3.6236 -2.3136 -1.6778 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7505 -1.0832 0.4025 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9326 -0.1263 0.2881 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2721 -1.3785 0.4543 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5121 -3.5162 -0.1356 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8155 1.2368 0.0249 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4848 0.3434 -0.7957 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7258 -0.1264 -1.1500 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4758 -1.2428 -2.1102 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8057 -1.1491 -1.4138 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9223 -0.1001 0.1266 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8137 0.2823 1.3109 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8643 0.9568 -0.0191 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1468 -2.3348 -0.3998 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 0.6076 0.0712 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2270 2.2847 -0.2449 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5322 1.5861 -0.0644 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2422 3.2634 -0.3803 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 2.9141 -0.2902 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3647 -0.0334 0.2456 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8487 -0.0821 0.3188 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4968 -0.5341 1.4569 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8871 -0.5508 1.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7530 -0.9938 2.6633 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5771 -0.1209 0.3229 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8360 0.3128 -0.7645 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5588 -0.3200 -0.9773 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9461 0.8453 -1.5754 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4539 -0.9966 -3.1655 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6601 -0.8372 -2.0029 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0396 -1.8835 -0.6538 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3388 1.2350 1.2154 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2513 -0.4190 0.2474 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0965 -3.6992 0.7712 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4373 -4.2429 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5252 4.2969 -0.5562 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1382 3.6869 -0.3979 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4742 2.0058 -0.0806 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4414 -0.8982 2.3192 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2848 -1.9655 2.4772 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4186 -1.1064 3.5264 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9844 -0.2688 2.9512 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2949 0.6868 -1.6736 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9838 -0.9344 -1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 17 1 0 0 0 0 3 21 1 0 0 0 0 4 32 1 0 0 0 0 5 32 1 0 0 0 0 6 14 1 0 0 0 0 6 19 1 0 0 0 0 7 25 2 0 0 0 0 8 30 1 0 0 0 0 8 32 1 0 0 0 0 9 16 1 0 0 0 0 9 19 2 0 0 0 0 10 19 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 22 1 0 0 0 0 11 25 1 0 0 0 0 11 43 1 0 0 0 0 12 26 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 37 1 0 0 0 0 18 20 1 0 0 0 0 18 21 2 0 0 0 0 20 22 2 0 0 0 0 20 38 1 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 28 44 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 30 31 2 0 0 0 0 31 48 1 0 0 0 0 32 49 1 0 0 0 0 M END $$$$