MMs00037984 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 47 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 -0.7455 1.3016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0089 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5089 2.5929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2545 1.2913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2634 3.8894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 3.8842 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6492 5.0947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1906 6.5229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0742 4.6263 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0742 5.8263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3758 5.3718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6723 4.6173 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6671 3.1173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3655 2.3718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 3.1263 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6409 2.6677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1724 1.2427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9739 5.3629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9790 6.8629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2703 4.6084 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5809 5.7675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4220 3.1161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8881 2.7992 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.6426 4.0956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1349 4.2473 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6427 5.2138 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6036 -1.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9455 1.3057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5875 3.6393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4544 1.2872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0964 -1.0464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1372 4.3037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4758 5.0704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6076 6.2937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1503 6.2884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2583 3.2195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0737 1.9883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1337 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 1.4552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8220 3.1182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2925 1.9231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8963 6.3867 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 1 0 0 0 0 8 18 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 13 1 0 0 0 0 11 17 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 20 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 28 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 44 1 0 0 0 0 M END