MMs01715991 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 0.0099 -1.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0294 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3138 -2.2414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3237 -3.7414 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0296 -4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2744 -3.7585 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2744 -4.9585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2842 -2.2585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5684 -4.5170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6276 -4.4828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6375 -5.9828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9217 -3.7243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2256 -4.4657 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5197 -3.7072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6667 -2.2144 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1318 -1.8929 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8903 -3.1870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8940 -4.3083 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2155 -5.7734 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3831 -3.3340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3795 -2.2127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7538 -2.8138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6068 -4.3066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1416 -4.6281 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0079 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7168 -1.1111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4969 -2.4420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8069 -5.4141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7357 -5.4242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1753 -3.4817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6037 -5.1238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9616 -5.5522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1443 -2.8101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 -2.8000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3290 -6.5823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3592 -6.1368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1223 -1.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7890 -2.2070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5038 -5.1037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 M END