MMs02055642 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 -1.4999 -0.0126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 -1.3179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4781 -2.6106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0219 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7609 -1.2927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2609 -1.2801 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1527 -2.4861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5753 -2.0106 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2648 -3.1697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5627 -0.5106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1323 -0.0591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6568 1.3635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7963 -2.8820 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1614 -2.2604 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.7830 -3.6255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5398 -0.8953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5265 -1.6388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7474 -2.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1126 -1.8886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2568 -0.3956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0359 0.4759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6708 -0.1457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6219 0.2261 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 13.8428 -0.6454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7662 1.7191 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.7389 -1.3306 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5912 1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1087 1.0215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0693 -3.6549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6306 -3.6321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1186 -3.0948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -3.5782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7572 -0.6260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8023 0.6652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6809 -4.0765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6320 -3.7047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0893 -2.5857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1513 1.6703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6940 0.5514 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 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 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END