MMs02499454 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 56 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 0.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2427 1.3115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4855 2.6064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0145 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7572 1.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4859 4.0220 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7965 5.1811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7227 4.9104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9411 4.0355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3651 4.5070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9151 4.4776 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0742 4.7882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2351 5.9431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6642 6.3986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 6.9529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3032 6.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4123 7.5073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0923 8.9727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3369 9.4283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 8.4184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6569 10.8938 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.2014 9.9826 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.0242 3.4677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7041 2.0023 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 1.5467 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4533 3.9233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7733 5.3888 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5624 2.9134 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9916 3.3690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3116 4.8344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7407 5.2900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8499 4.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5298 2.8147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1007 2.3591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7807 0.8936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4606 -0.5718 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2790 4.7357 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -12.3881 3.7258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5990 6.2012 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5942 -1.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1058 -1.0275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4427 1.3182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9572 1.2882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4312 5.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5556 7.1428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5893 8.7829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 0.3743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8314 1.9506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3064 1.7410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4243 5.6424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9968 6.4624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4171 2.0068 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 41 1 0 0 0 0 2 3 2 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 3 43 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 47 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 33 34 2 0 0 0 0 33 38 1 0 0 0 0 34 35 1 0 0 0 0 34 53 1 0 0 0 0 35 36 1 0 0 0 0 36 37 3 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 M CHG 1 38 1 M CHG 1 40 -1 M END