MMs00458672 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 0.7427 -1.3032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0146 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7281 -3.9013 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -3.9097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9707 -5.2129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9853 -2.6149 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1853 -2.6217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2427 -1.3117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0169 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0292 -5.1961 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6292 -4.1568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5732 -6.5698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5472 -7.5672 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3957 -8.4157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 -6.8099 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6905 -5.9614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5219 -5.3445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2157 -7.4123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4243 -6.5238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7980 -7.1262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0065 -6.2377 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 -5.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3988 -9.0598 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9681 -9.6777 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3350 -10.2955 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 1.0426 0.5941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5941 1.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0426 -0.5941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2146 -2.5913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6158 -5.9757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -7.5446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5503 -8.4109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0836 -8.2410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1326 -8.1248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6659 -7.9549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2151 -5.3492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8950 -7.4463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0877 -7.3141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3141 -5.8311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 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 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 24 25 2 0 0 0 0 25 26 2 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 25 1 M CHG 1 26 -1 M END