MMs01992481 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 0.7420 -1.3036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -2.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -1.3128 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0184 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5999 -1.0577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2579 1.2852 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6579 2.3244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0159 2.5796 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6159 3.6188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5159 2.5704 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7159 2.5704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2579 1.2668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0276 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6999 -0.0276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2419 -1.3313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7419 -1.3405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4839 -2.6441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9839 -2.6533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7418 -1.3589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 -0.0553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2418 -1.3681 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.9998 -0.0737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9838 -2.6717 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.2738 3.8648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5318 5.1684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2739 3.8832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 1.2944 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0429 0.5936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5936 1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0429 -0.5936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8356 -2.3557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8775 -3.6796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5775 -3.6962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6062 0.9803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9063 0.9968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1883 3.0878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1978 4.6305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1382 6.2039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0739 3.8906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1644 2.3373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 29 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 28 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 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 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 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 27 40 1 0 0 0 0 28 41 1 0 0 0 0 29 42 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END