BR84EO -OEChem-04022103403D 27 29 0 0 0 0 0 0 0999 V2000 -2.7326 2.5044 -0.5487 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6845 -1.7395 -0.6998 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6423 0.6592 0.1737 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 1.3182 0.5290 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3391 -0.9285 0.9445 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5529 -1.5273 0.1342 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7409 0.3693 -0.6341 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5843 0.5345 1.5062 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2291 0.3143 0.9878 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5187 -0.6777 0.4266 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7054 0.1592 0.5425 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 1.2981 -0.3689 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7229 -1.0218 -0.4173 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0866 -1.1752 0.4014 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3495 1.1504 -0.1978 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1120 -1.5183 -0.4799 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3748 0.8075 -1.0791 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7561 -0.5269 -1.2202 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7187 -0.0442 2.4299 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7104 1.5820 1.8111 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4478 -2.5179 0.3265 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5965 0.7414 -1.0375 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 -1.9564 0.9733 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0605 2.1933 -0.0987 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 -2.5572 -0.5897 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 1.5793 -1.6559 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5544 -0.7939 -1.9065 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 13 2 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 12 1 0 0 0 0 4 9 2 0 0 0 0 5 9 1 0 0 0 0 5 10 2 0 0 0 0 6 10 1 0 0 0 0 6 13 1 0 0 0 0 6 21 1 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 15 17 2 0 0 0 0 15 24 1 0 0 0 0 16 18 2 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 27 1 0 0 0 0 M END $$$$