MMs02529893 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 62 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 0.7603 -1.2930 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2602 -1.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2601 -1.2573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5205 -2.5623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0205 -2.5742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7601 -1.2454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 0.0595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5204 -2.5385 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0203 -2.5266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7806 -3.8196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2806 -3.8077 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1526 -2.5872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5828 -3.0394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5947 -4.5394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1719 -5.0142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8716 -6.4838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9943 -7.4787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4172 -7.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7174 -5.5342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7893 -2.1481 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.6207 -0.6576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8272 0.2336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2023 -0.3656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6585 1.7241 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2834 2.3233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1148 3.8138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3213 4.7051 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6964 4.1059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8650 2.6154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0344 0.6082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6082 1.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0344 -0.6082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3917 1.0582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0916 1.0797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1287 -3.5967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4288 -3.6181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9286 -3.5824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8026 -1.3465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1447 -2.1072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6563 -4.2390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9984 -4.9997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7727 -1.4489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7334 -6.8637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7541 -8.6544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3153 -7.7997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8557 -5.1543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4698 -0.9976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0861 0.4167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0024 1.1567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0857 2.3975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9639 3.4739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5802 4.8882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9775 5.2725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8941 4.0317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3996 1.5411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0159 2.9553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 39 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 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 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 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M END