MMs03451254 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 -1.5000 -0.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2548 1.2907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5096 2.5925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0096 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7452 1.3018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2452 1.3074 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7548 1.2851 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7492 -0.2149 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7604 2.7851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2548 1.2796 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1410 2.4898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5658 2.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5602 0.5210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1320 0.0628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7705 -0.3652 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.7313 -0.9652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1431 0.2398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3054 1.7310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6780 2.3360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8882 1.4499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7259 -0.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3533 -0.6463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1910 -2.1375 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -14.2608 2.0549 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -8.6082 -1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6039 -1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0961 -1.0470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1135 3.6295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5865 3.6395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 0.2704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8413 2.3488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7744 3.6324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5392 2.7227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7569 -1.0771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3372 2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8078 3.5290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6941 -0.7503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5764 -2.5653 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 26 39 1 0 0 0 0 M END