BLRG39 -OEChem-04042104403D 26 27 0 0 0 0 0 0 0999 V2000 -5.6642 -0.0988 -0.1120 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5517 -0.3793 0.4234 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9144 -1.6159 0.4648 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1506 0.9283 -0.3210 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2245 -1.2278 0.2837 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 0.5237 -0.1662 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6271 0.8466 -0.1444 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7482 1.2756 -0.3441 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8798 -0.9107 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2383 1.0169 1.0977 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3348 0.2643 -1.1961 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0094 -0.1354 -0.0485 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 0.0226 0.2367 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5572 0.6050 1.2882 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6538 -0.1477 -1.0056 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2171 -0.9672 -0.6936 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8607 2.3161 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4306 1.8629 -0.5934 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6997 1.4690 1.9272 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8712 0.1251 -2.1699 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5893 -2.1411 0.5289 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0281 0.7401 2.2581 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1449 -0.5924 -1.8643 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3206 -0.2561 -1.5202 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7328 -1.8988 -1.0058 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2293 -1.2271 -0.3668 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 13 1 0 0 0 0 2 16 1 0 0 0 0 3 9 2 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 4 18 1 0 0 0 0 5 9 1 0 0 0 0 5 12 1 0 0 0 0 5 21 1 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 8 17 1 0 0 0 0 10 14 1 0 0 0 0 10 19 1 0 0 0 0 11 15 2 0 0 0 0 11 20 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 22 1 0 0 0 0 15 23 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 M END $$$$