BEC94B -OEChem-04012113213D 29 31 0 0 0 0 0 0 0999 V2000 -1.2361 -2.1882 -0.7391 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5948 -1.5715 -0.2137 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -0.0914 -0.2832 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0879 -1.9959 -0.4689 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 2.0908 -0.6496 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4149 2.4976 -0.4697 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3155 1.6090 -0.0198 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1133 -0.9734 1.9471 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2135 0.2392 -0.0804 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9549 -0.9383 -0.2102 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2453 -1.5073 -0.5114 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2276 0.8017 -0.2794 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3261 -0.9922 -0.0631 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8529 1.4147 0.2694 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9762 0.1998 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2458 1.3892 0.4233 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5548 0.5178 0.1031 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4582 0.2137 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1174 -0.7153 0.5694 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3738 -2.9585 -0.5992 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8679 -1.9249 -0.1753 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3137 2.3422 0.4222 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7604 2.3108 0.6871 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9343 -0.5789 -0.1623 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8845 1.1638 0.0856 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7140 0.0690 1.4793 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6852 3.4544 -0.6684 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7302 -0.3133 2.6163 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4958 -1.8373 2.3168 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 19 2 0 0 0 0 3 9 1 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 12 2 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 17 2 0 0 0 0 8 19 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 13 1 0 0 0 0 12 17 1 0 0 0 0 13 15 2 0 0 0 0 13 21 1 0 0 0 0 14 16 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 23 1 0 0 0 0 17 19 1 0 0 0 0 18 24 1 0 0 0 0 18 25 1 0 0 0 0 18 26 1 0 0 0 0 M END $$$$