MMs01279479 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 52 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 -0.0579 -1.4989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2112 -2.2985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5382 -1.5992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5961 -0.1003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 0.6993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0396 0.3078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5578 1.7154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8737 -0.9388 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9459 -2.1174 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5396 -3.5614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 -3.1349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3726 -0.9968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1722 0.2724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4729 1.5994 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6711 0.2145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4707 1.4836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9696 1.4257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6688 0.0986 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8693 -1.1705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3704 -1.1126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1677 0.0407 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.1098 -1.4581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2256 1.5396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6666 -0.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3659 -1.3442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8648 -1.4021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6644 -0.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9651 1.1940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4662 1.2519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1633 -0.1909 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0153 0.6397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1195 -2.0583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1649 -3.4976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3733 1.8984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1188 -2.1696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4836 -1.4504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3597 1.9372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7245 2.6564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8070 2.6146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1122 1.7922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9802 -1.6241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6154 -2.3433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2277 -1.4792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5330 -2.3015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7262 -2.3595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4242 -2.4637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6048 2.2093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9068 2.3136 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 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 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 30 49 1 0 0 0 0 M END