MMs03836531 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 1.5000 0.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2545 -1.2912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7545 -1.2860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 -2.5824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0090 -2.5772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7545 -1.2755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2545 -1.2703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0090 -2.5668 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5090 -2.5615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2545 -1.2599 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2635 -3.8580 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7635 -3.8527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5090 -2.5511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0089 -2.5459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7635 -3.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0180 -5.1439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5180 -5.1492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7725 -6.4508 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 15.7544 -1.2442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2544 -1.2390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0042 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0042 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2875 1.1863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6262 0.4196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9126 -3.6237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6126 -3.6143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5963 1.0622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8964 1.0528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4126 -3.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6671 -4.8993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9053 -1.5140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9635 -3.8381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6216 -6.1811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9999 0.0522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5963 1.0935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 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 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 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 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 39 40 1 0 0 0 0 M END