MMs02257081 MOE2007 2D CORINA 3.40 0006 02.08.2006 27 27 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 0.7422 -1.3035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2422 -1.3124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9845 -2.6159 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2267 -3.9104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9690 -5.2139 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7268 -3.9015 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1206 -4.9372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0155 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5155 -2.5891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4844 -2.6248 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8844 -3.6641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2267 -3.9283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7267 -3.9373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4844 -2.6427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4689 -5.2407 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8627 -6.2764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6689 -5.2479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2422 -1.3303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7421 -1.3392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0428 0.5938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5938 1.0428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0428 -0.5938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8484 -0.2768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0966 -4.3320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4280 -5.1113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0268 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 M CHG 1 27 -1 M END