MMs03811445 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 62 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 1.4757 0.2691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4465 -0.8744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9222 -0.6053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 -1.7487 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7339 -2.0593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3687 -1.4797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4538 -2.5154 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7741 -1.8035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5050 -0.3278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0184 -0.1277 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.1261 -2.4532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2394 -3.9489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3647 -1.6071 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7167 -2.2568 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.8682 -3.1054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8301 -3.7525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9554 -1.4108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5191 -1.5247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7736 -0.6121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4198 0.8199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8303 0.8884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6182 0.0228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9008 -0.0166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2703 -1.3461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9634 -1.5589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1052 -2.2030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2153 1.1805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1805 -0.2153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2153 -1.1805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0587 1.3943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5114 0.8751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4108 -1.4804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8635 -1.9996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5052 0.5199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9579 0.0007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3336 0.5403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2740 -0.4106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6335 -3.8432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9207 -4.9491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0266 -3.6619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3063 -2.0858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9959 -1.8889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8128 -0.0121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6069 0.9958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3574 2.0183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5197 2.0475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4955 -0.4007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0530 1.0813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1220 0.5411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0991 -0.0805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5703 -1.8657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9818 -0.9242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2208 -2.7310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3190 -3.1096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9190 -3.0849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2077 -3.3765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3882 -3.1612 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1649 -4.0760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 58 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 37 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 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 57 58 1 0 0 0 0 58 59 1 0 0 0 0 M END