MMs01691578 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 39 0 0 0 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 1.3017 -0.7454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3069 -2.2454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8997 -0.7363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4978 -0.7272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0958 -0.7181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1011 -2.2181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8047 -2.9726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4028 -2.9635 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6992 -2.2089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0008 -2.9544 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.6939 -0.7089 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3870 1.5365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9850 1.5456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2814 2.3002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2762 3.8001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5963 1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0413 0.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5963 -1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5938 1.2091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1316 -1.6583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6743 -1.6529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4216 0.9348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9642 0.9402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5020 -1.9272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7900 1.2274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4070 -4.1635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4047 -1.0806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1713 0.2581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8040 1.3331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5707 2.6718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4762 3.8044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2720 5.0001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0762 3.7959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M END