MMs00838608 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 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 0.7437 -1.3026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2437 -1.3098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9875 -2.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2312 -3.9079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -5.2105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -5.2177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2312 -3.9223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4875 -2.6197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2437 -1.3243 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7437 -1.3315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4874 -2.6341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8757 -1.2610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5568 -2.7267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6667 -3.7357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0955 -3.2791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4144 -1.8134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3045 -0.8043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3117 0.6957 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2859 1.3963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8874 1.1660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4307 2.5948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4398 3.7047 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0421 0.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0421 -0.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3858 -1.7076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9464 -2.4854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0313 -3.9021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 -6.2468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0700 -6.2598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4312 -3.9281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6487 -0.2821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3743 0.3798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7140 1.1447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4138 -3.0920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4116 -4.9083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9834 -4.0863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5574 -1.4480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9650 2.9137 0.0000 O 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 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 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 14 23 2 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 42 2 0 0 0 0 M CHG 1 25 -1 M END