MMs01726219 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 52 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 -1.2981 0.7516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5999 -1.4969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3018 -2.2484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0018 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2963 -2.2516 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2571 -2.8516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5963 -1.5031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8944 -2.2547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1943 -1.5063 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1943 -2.7063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6428 -1.8963 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3322 -3.0554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0327 -0.4479 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5843 -0.0579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8359 1.2421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4821 -0.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5415 -1.1233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1515 -2.5717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7021 -2.9582 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.9908 -0.7368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0502 -1.7988 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.4996 -1.4123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0388 -0.0126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5367 -0.0929 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.0429 -1.9737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9231 -1.5423 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.6641 -2.3577 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8721 1.3870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8127 2.4490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8962 0.7547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 0.5987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2967 1.9516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6398 -2.0956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3032 -3.4484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8929 -3.4547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3468 -2.6778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2546 -3.7673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4850 0.3513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9746 -0.0497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3865 0.9946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2545 -4.3503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9362 0.1560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3214 1.7735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2945 -3.7516 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -4.3528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6334 2.9323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 47 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 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 19 20 2 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 29 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 31 32 2 0 0 0 0 31 46 1 0 0 0 0 33 45 1 0 0 0 0 44 47 1 0 0 0 0 46 49 1 0 0 0 0 47 48 1 0 0 0 0 M END