MMs01077697 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 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 1.4222 0.4768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6439 -0.3935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8491 0.4995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3723 1.9217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8724 1.9077 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2426 3.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7358 3.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6061 4.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9832 5.5868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8536 6.8085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2307 8.1731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7375 8.3159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8672 7.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4901 5.7296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6198 4.5079 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0993 4.0794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9696 5.3011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7222 2.7148 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2154 2.5719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8382 1.2074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3314 1.0645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2017 2.2862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5788 3.6508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0857 3.7937 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9679 -0.0143 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.3815 1.1378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1378 -0.3815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3815 -1.1378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6551 -1.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9938 0.1393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2341 1.9089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0481 6.6942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9269 9.1504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2392 9.4076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6726 7.2085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0259 1.7374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8297 -0.0271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3963 2.1719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2751 4.6282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 M END