MMs02336486 MOE2007 2D CORINA 3.40 0006 02.08.2006 22 22 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 0.5697 1.3876 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5894 1.0770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9538 1.9659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9491 3.4659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3414 1.3962 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9197 0.0121 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7197 0.0121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3499 -1.3755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9659 -1.9538 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5783 -1.3840 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4197 0.0168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1737 -1.2800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9543 0.7276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9498 -0.7335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1873 2.2473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5401 -1.5284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5102 -2.5647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1656 1.3181 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4942 2.4450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1872 3.6050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6523 2.1308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 11 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 19 -1 M END