B1EVP7 -OEChem-04022106123D 39 42 0 0 0 0 0 0 0999 V2000 2.5334 -2.5948 -0.7808 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0805 1.0189 -1.1250 F 0 0 0 0 0 0 0 0 0 0 0 0 0.1769 -2.1484 0.5481 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2815 -3.1967 -0.7289 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0253 -3.3383 -1.2845 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0915 2.3629 0.3234 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3353 0.6655 -0.7115 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7235 0.6544 -0.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4235 2.3773 0.5705 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7591 2.3413 0.7793 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1564 -2.4828 0.3695 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8309 -2.7080 -0.5117 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6505 -1.3966 1.6156 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6368 -1.0802 -1.7776 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0821 -2.0213 1.3463 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5601 0.1616 -0.9328 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2248 -0.9606 2.5372 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6353 -1.2904 2.3867 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2233 2.0222 -0.0451 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3443 1.7729 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2885 2.3388 0.7981 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4611 1.3668 -1.2532 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5778 1.7625 0.2662 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5914 2.0002 0.4333 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7642 1.0281 -1.6182 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8293 1.3447 -0.7748 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -1.1875 1.6886 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8469 -1.0732 -2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5923 -1.0932 -2.3132 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1345 -2.2598 1.2418 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0885 -0.3730 3.3914 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3212 -0.9248 3.1432 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1564 3.1095 1.0088 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1162 2.8474 1.7433 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6691 1.1380 -1.9584 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4207 2.2455 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9512 0.5250 -2.5623 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6515 1.9127 0.5758 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6982 3.1765 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 14 1 0 0 0 0 2 26 1 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 2 0 0 0 0 5 12 2 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 6 33 1 0 0 0 0 7 16 1 0 0 0 0 7 20 2 0 0 0 0 8 16 2 0 0 0 0 8 23 1 0 0 0 0 9 20 1 0 0 0 0 9 23 2 0 0 0 0 10 23 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 15 1 0 0 0 0 13 17 2 0 0 0 0 13 27 1 0 0 0 0 14 16 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 18 2 0 0 0 0 15 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 21 24 1 0 0 0 0 21 34 1 0 0 0 0 22 25 2 0 0 0 0 22 35 1 0 0 0 0 24 26 2 0 0 0 0 24 36 1 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 M END $$$$