BE05VZ -OEChem-04022105253D 42 45 0 0 0 0 0 0 0999 V2000 -2.8379 -0.5523 -1.9358 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8155 -0.6870 -0.0511 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0412 -0.6603 -0.4810 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7160 1.8930 0.0043 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1909 -0.1240 0.3253 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2837 0.0534 -0.7927 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2539 0.6965 0.4369 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2523 -0.3518 -1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9218 -1.1993 0.9868 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1156 -0.9962 -1.5584 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4757 -0.5932 0.8688 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1923 -0.6097 0.1579 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8986 0.5991 -0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4087 -0.4548 -0.7842 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8893 -1.7630 0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2768 0.6069 0.2247 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5273 1.9239 -0.3643 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9868 -0.5381 0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 -1.7256 0.7543 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6661 2.6960 -0.3523 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5799 0.1558 0.3538 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1348 0.5179 1.5643 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4897 0.7790 1.5456 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5961 0.3338 -0.6808 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1421 0.7342 -1.4448 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9213 -0.6861 -2.1621 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3179 -0.9786 1.9856 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8578 -2.2905 0.8923 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5283 -0.6979 -2.5278 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0245 -2.0893 -1.5674 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1374 -1.1114 1.5705 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4493 0.4675 1.1464 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3679 -2.7097 0.6589 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5388 2.2921 -0.5986 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0579 -0.5100 0.7731 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7868 -2.6336 1.0457 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 2.1992 0.0938 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8218 3.7448 -0.5621 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7306 -0.0128 1.2219 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5604 0.5966 2.4788 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0141 1.0707 2.4494 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1854 0.2595 -1.5865 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 2 12 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 3 14 1 0 0 0 0 4 16 1 0 0 0 0 4 20 1 0 0 0 0 4 37 1 0 0 0 0 5 14 1 0 0 0 0 5 21 1 0 0 0 0 5 39 1 0 0 0 0 6 21 2 0 0 0 0 6 24 1 0 0 0 0 7 23 1 0 0 0 0 7 24 2 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 15 19 1 0 0 0 0 15 33 1 0 0 0 0 16 18 1 0 0 0 0 17 20 2 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 M END $$$$