MMs00015882 MOE2007 2D CORINA 3.40 0006 02.08.2006 29 30 0 0 1 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7573 -1.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0146 -2.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -1.2864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 0.0168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 0.0253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2426 1.3285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7426 1.3369 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 0.0421 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.3484 -0.8064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7947 0.7994 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.6432 1.6479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0374 2.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4175 3.5452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7572 -1.2611 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.2572 -1.2695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4853 2.6233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2280 3.9265 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0358 -0.6058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6058 1.0358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0358 0.6058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 0.4209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2017 1.1998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1319 -1.6863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4722 -2.4501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2457 0.4193 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.0895 1.2726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5628 -0.7380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9854 2.6149 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 6 7 2 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 29 2 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 18 -1 M END