MMs02511027 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 -1.5000 0.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2424 1.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4848 2.6068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0151 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7575 1.2946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2273 3.9101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7272 3.9189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4848 2.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9848 2.6330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7272 3.9363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2272 3.9451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9696 5.2310 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4697 5.2223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7121 6.5169 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7423 1.3383 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.5832 1.0277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2350 1.1902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5554 -0.2752 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.8660 -1.4343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2607 -1.0327 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1016 -1.3433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1402 -0.0355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1126 -2.5254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7459 -3.1435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9292 -0.8773 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.1376 0.0114 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -12.3460 0.9002 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 0.5939 -1.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 -1.0270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4424 1.3191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6212 3.6338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9575 1.2877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0973 4.3140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4288 5.0931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8909 1.5815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5121 6.5099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3061 7.5596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2280 2.3902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4277 1.3226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3092 -2.4347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4097 -3.6880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6274 -4.3376 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 27 28 2 0 0 0 0 M CHG 1 27 1 M CHG 1 28 -1 M END