MMs03123451 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 0.7556 -1.2958 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4444 -1.2958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0111 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7667 -3.8939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4889 -2.6045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2333 -3.9067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2555 -1.2894 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 -0.0721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6624 1.3525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5606 -0.5295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7703 0.3573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1432 -0.2469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4614 -1.7128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9538 -1.8632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5580 -0.4903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4390 0.5087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0239 -0.1721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0324 -1.2825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4983 -0.9644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9557 0.4642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9472 1.5746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4813 1.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4215 0.7823 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.5670 -2.0295 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1424 -2.4991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6850 -3.9277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0367 0.6044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6044 1.0367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0367 -0.6044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2751 -3.3112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8289 -4.9485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1915 -4.5023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6398 1.5502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6622 -2.6080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5583 -2.8998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6664 -2.4254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3050 -1.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3131 2.7174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6746 2.1448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 2 0 0 0 0 4 6 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 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 25 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 17 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 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 25 26 1 0 0 0 0 26 27 2 0 0 0 0 M END