MMs03219639 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 44 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 1.5000 0.0092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2579 -1.2852 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 1.6356 2.3484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7419 1.3221 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1419 2.3613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0369 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7579 -1.2575 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5579 -1.2575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0159 -2.5611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7738 -3.8555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2738 -3.8463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0158 -2.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2578 -1.2483 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4578 -1.2483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 0.0553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 0.0646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2418 1.3682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2578 -1.2298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4839 2.6257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9839 2.6349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 3.9201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 5.2237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0074 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0074 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3748 -0.3897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7156 -1.1528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0919 -1.7955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1014 -3.3381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6488 -4.2729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9895 -5.0360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0727 -5.0293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4039 -4.2498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9398 -3.3084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4731 -2.1542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7400 -1.5330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8642 -2.2654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2933 -0.6235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5109 4.6301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0616 6.2666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4251 5.8173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END