MMs02087778 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 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 2.5980 0.0151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3121 -2.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6154 -2.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6241 -4.4848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9362 -6.7273 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9362 -7.9273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2396 -7.4697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5343 -6.7122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5255 -5.2122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8376 -7.4546 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1323 -6.6971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1236 -5.1971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4182 -4.4396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7216 -5.1821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7303 -6.6820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4357 -7.4396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4444 -8.9395 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 13.0163 -4.4245 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.6416 -7.4848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3382 -6.7423 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 1.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0427 0.5940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -1.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2041 -1.0207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6338 0.6211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 1.0508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9082 -3.3724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1291 -2.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0193 -1.8549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7984 -3.1864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4412 -4.2833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2203 -5.6148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4736 -8.3934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0163 -8.3845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8446 -8.6546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0809 -4.6032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4113 -3.2396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7730 -7.2760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3034 -0.7424 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9275 -5.2273 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9632 -4.6213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6503 -8.9848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6145 -9.5908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 40 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 6 41 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 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 16 39 1 0 0 0 0 17 18 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 41 42 1 0 0 0 0 43 44 1 0 0 0 0 M END