MMs00398892 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 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 -0.7553 1.2959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0107 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4893 2.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2447 1.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7106 1.6261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8613 3.1186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4884 3.7230 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1706 5.1890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7421 5.6466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3685 4.6384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2291 3.7343 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4462 2.8576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2955 1.3652 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9277 0.7495 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8140 3.4733 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0311 2.5966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3989 3.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5496 4.7048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6161 2.3357 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9839 2.9514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2010 2.0747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6257 2.5441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5123 1.3342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6356 0.1170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2072 0.5747 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5957 -1.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9553 1.2910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6149 3.6348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1042 -1.0306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3696 5.2358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3327 6.3780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1713 1.7595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7062 1.6045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4955 1.1417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3088 3.9435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8436 3.7885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9918 3.6868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7123 1.3391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0111 -1.0227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4242 7.1126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7186 7.4787 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 42 43 1 0 0 0 0 M END