MMs03254914 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 42 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 -0.0065 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2444 -1.3087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4888 -2.6045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9462 -4.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7289 -4.9095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8792 -6.4020 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0946 -7.1031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2469 -7.0180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3973 -8.5104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4642 -6.1415 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5584 -6.6343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3139 -4.6491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5312 -3.7726 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4808 -4.0226 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0112 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7556 -1.2958 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9094 -4.4800 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0609 -5.3285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1191 -3.5931 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1584 -2.9931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3364 -4.4696 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1850 -5.3181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8791 -5.8981 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2791 -6.9374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3791 -5.9046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7660 -7.1078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1618 -8.4808 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7610 -3.9999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1127 -2.0931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7444 -1.3152 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5955 1.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5958 -6.2411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7637 -7.7746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8713 -9.4486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0055 -2.8251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1493 -1.4887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3399 -2.3570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3488 -0.2785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 16 2 0 0 0 0 5 6 2 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 9 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 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 29 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 33 1 0 0 0 0 27 34 1 0 0 0 0 28 35 1 0 0 0 0 29 36 1 0 0 0 0 30 37 1 0 0 0 0 31 38 1 0 0 0 0 31 39 1 0 0 0 0 M END