B6SHG2 -OEChem-04022110533D 27 28 0 0 0 0 0 0 0999 V2000 -1.7414 -2.5204 -0.4303 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6366 -1.1012 0.2479 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0615 0.0760 0.5545 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6255 -0.6009 -0.9056 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9264 0.2060 1.4444 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3515 0.4459 0.6938 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4131 -0.4501 0.8201 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4477 -1.0310 -0.2473 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9805 1.0892 0.3587 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4776 1.5650 -0.1294 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6008 -0.2272 0.1234 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9112 0.6809 -0.5126 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6654 1.7882 -0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7269 0.8920 -0.6998 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8222 -0.8123 -0.4918 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8587 -0.7186 2.0295 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0988 1.0226 2.1562 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3254 -1.3242 1.4607 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9001 2.0387 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3337 2.2798 -0.2327 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1785 -1.1383 -1.5617 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7704 1.2064 -0.8938 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7635 2.6612 -1.4648 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6203 1.1259 -1.2685 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5408 -1.6095 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2802 0.1280 -0.1668 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 -0.8330 -1.5714 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 2 11 1 0 0 0 0 2 15 1 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 8 1 0 0 0 0 4 12 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 11 1 0 0 0 0 7 18 1 0 0 0 0 9 12 2 0 0 0 0 9 19 1 0 0 0 0 10 13 2 0 0 0 0 10 20 1 0 0 0 0 11 14 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 M END $$$$