MMs01363707 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 1.5000 0.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2409 1.3146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7409 1.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4819 2.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8623 3.9953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9700 5.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2742 4.2657 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9725 2.7963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9839 1.6886 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4490 2.0106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9026 3.4404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4604 0.9029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9254 1.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9368 0.1172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4832 -1.3126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0181 -1.6346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0067 -0.5269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5417 -0.8489 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 13.4018 0.4392 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.0798 1.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7238 -1.0258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8668 0.7612 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.8782 -0.3465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3433 -0.0245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7969 1.4053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7855 2.5130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3205 2.1910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 6.4717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2182 6.9253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1105 5.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4325 4.4489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0083 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0083 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2998 -1.1728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6304 -0.3922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6210 0.5448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2883 2.3687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2923 -2.1988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6552 -2.7784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8650 -0.9895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3355 -1.4560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3934 -1.2234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5327 -0.1833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7987 3.1560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3283 3.6225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1310 2.3498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2703 3.3899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8470 6.5219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8068 7.6611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7743 7.9887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2675 7.6575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4676 6.9271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 5.4567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2738 3.2594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2336 4.3987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 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 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 M END