MMs02585339 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 53 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 0.7462 -1.3012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0075 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7387 -3.8993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2387 -3.9036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9925 -2.6067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2462 -1.3055 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2531 -0.1937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6217 -0.8078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4606 -2.2991 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9229 -0.0615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9272 1.4384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2284 2.1847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5253 1.4309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5210 -0.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2198 -0.8153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8178 -0.8228 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1190 -0.0766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1234 1.4234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4159 -0.8303 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.3767 -1.4303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4116 -2.3303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7084 -3.0841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0096 -2.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0140 -0.8378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7171 -0.0841 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.7563 0.5159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7214 1.4159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0226 2.1622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 0.5970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 1.0410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 -0.5970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2075 -2.5946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1357 -4.9368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8357 -4.9446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0070 0.9808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8897 2.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2319 3.3847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5663 2.0279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2163 -2.0153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8144 -2.0228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2304 -2.1185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9979 -3.4568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9344 -4.0011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4771 -4.0055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4168 -3.4666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1920 -2.1329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1951 -1.0496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4276 0.2886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4246 2.1697 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 M CHG 1 50 -1 M END