BDHZ67 -OEChem-04022103203D 28 29 0 0 0 0 0 0 0999 V2000 -3.1116 -2.8608 -0.0023 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5611 -1.1436 -0.0014 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2399 1.1100 0.0003 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0389 0.5581 -0.0013 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4356 1.8400 -0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3369 -1.4062 0.0038 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5407 0.6583 0.0015 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2881 0.2178 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8987 -0.6356 0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8389 -1.6653 -0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5819 1.7400 0.0045 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6237 0.8026 -0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7227 1.9686 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0502 0.2529 1.2026 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0528 0.2492 -1.2026 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8988 -0.8413 1.1514 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9012 -0.8448 -1.1463 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9316 -0.9626 0.0028 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 -1.7929 -0.0025 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4709 2.3706 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6002 1.3370 0.0063 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4745 2.3720 -0.8834 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6926 -0.2155 -0.0018 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1823 2.9700 -0.0063 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7343 0.6608 2.1568 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7389 0.6542 -2.1587 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2601 -1.3070 2.0623 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2642 -1.3133 -2.0551 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 8 1 0 0 0 0 2 10 1 0 0 0 0 2 19 1 0 0 0 0 3 7 1 0 0 0 0 3 8 2 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 23 1 0 0 0 0 5 13 2 0 0 0 0 6 16 2 0 0 0 0 6 17 1 0 0 0 0 7 9 2 0 0 0 0 7 11 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 13 24 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 15 17 2 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 M END $$$$