MMs01242957 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 50 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 1.3330 -0.6878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5601 -2.1705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0404 -2.4127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7282 -1.0797 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -0.0136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7146 -3.7526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2121 -3.8388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8863 -5.1787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0630 -6.4326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5654 -6.3464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8913 -5.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4941 -3.2257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8749 -4.6766 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9528 -2.8301 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2575 -1.6695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0189 -3.8854 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3294 -2.7263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5188 -3.8777 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8294 -2.7186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5265 -5.3777 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0265 -5.3854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9713 -6.4514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9554 -5.8340 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1069 -6.6825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8309 -4.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9430 -3.4070 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.1465 -5.3365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0847 -3.7926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4262 -7.2582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4282 -8.3780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5502 1.0664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0664 0.5502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5502 -1.0664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8708 -2.8357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0843 -5.2476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6023 -7.5045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9068 -7.3495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6932 -4.9376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7229 -4.2840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1990 -5.9129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5701 -6.3890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4260 -2.7896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0878 -3.1339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7434 -4.7957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8950 -7.5626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2716 -8.7019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 27 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 29 43 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 30 31 2 0 0 0 0 30 46 1 0 0 0 0 46 47 1 0 0 0 0 M END