MMs01068581 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 -0.0082 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3113 2.2429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3195 3.7428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0246 4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2785 3.7570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2867 2.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2364 4.9114 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3908 6.1503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1085 6.1945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3078 7.3374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7202 6.8320 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 5.3327 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1638 5.5236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0175 6.7570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5124 6.6345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1538 5.2785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3001 4.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8052 4.1677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7137 3.1387 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3979 3.8587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 2.7923 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9047 1.6509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2886 1.0723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4796 -0.4155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4816 1.9816 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0066 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3473 1.6372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 4.3372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0312 5.6999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3292 1.6628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2867 7.9677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 8.4188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5044 7.8418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1953 7.6212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3498 5.1805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8132 2.9603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 1.7071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6411 0.4802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5888 1.5188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3289 3.1718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M END