BW7D6Q -OEChem-04042103043D 26 26 0 0 0 0 0 0 0999 V2000 0.5560 1.6049 -0.2814 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8932 1.7185 -1.6946 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3873 2.8161 0.5107 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6967 -2.3179 -0.2567 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2382 -0.3807 0.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7215 0.6134 0.4801 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9028 0.6588 -0.1258 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2508 -0.2550 -1.1205 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7208 0.8174 0.9928 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2352 -0.8516 0.1219 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4171 -1.0102 -0.9967 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8871 0.0622 1.1166 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9859 -0.7362 -0.0388 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4830 -1.6581 0.2537 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 -1.0818 0.2327 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8875 0.7488 1.4853 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6274 -0.3975 -1.9987 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4659 1.5174 1.7834 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6765 -1.7205 -1.7771 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5147 0.1924 1.9943 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8246 -0.7745 -1.1195 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3414 -1.4533 0.4771 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2499 -1.1112 0.8126 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9081 -1.8915 -0.7284 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2703 -2.5961 0.7759 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6295 -2.5738 -0.0937 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 4 15 1 0 0 0 0 4 26 1 0 0 0 0 5 15 2 0 0 0 0 6 13 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 11 1 0 0 0 0 8 17 1 0 0 0 0 9 12 2 0 0 0 0 9 18 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 11 19 1 0 0 0 0 12 20 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 M END $$$$