MMs03313368 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 40 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 0.1600 -1.4914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -2.9829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6916 -3.5901 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8515 -5.0815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6399 -5.9658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7317 -5.3586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8917 -3.8672 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 -6.4755 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9803 -7.7729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4863 -7.4579 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2251 -6.3218 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9146 -7.4810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2265 -7.4387 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0750 -8.2872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5981 -6.8315 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.6373 -6.2315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4445 -5.3394 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1339 -4.1803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9779 -5.0244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5613 -4.3381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9869 -4.8047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1038 -3.8034 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.2206 -2.8020 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9736 -1.6277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3611 -3.1753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1051 -4.9202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1025 -2.6865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8955 -7.5843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8929 -8.7843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9115 -8.9053 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2232 -5.6887 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9693 0.7074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -8.8702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6173 -3.5973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1269 -3.2798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3511 -6.8818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1925 -4.9813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 31 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 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 1 0 0 0 0 23 24 1 0 0 0 0 23 27 2 0 0 0 0 23 28 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 29 30 1 0 0 0 0 32 37 1 0 0 0 0 32 38 1 0 0 0 0 M CHG 1 31 -1 M END