MMs00076714 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 39 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 1.2944 0.7580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8924 0.7741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8831 2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5795 3.0160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2851 2.2580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5702 4.5160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1775 3.0320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1683 4.5320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4812 2.2901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7755 3.0481 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0792 2.3061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4457 2.9247 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3584 0.0069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4563 1.8162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7143 0.5125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2452 0.8153 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9471 1.9822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9576 0.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3242 1.4922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1581 2.9830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6890 3.2858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6064 1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0355 -0.6064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6064 -1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6054 -1.1839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9353 0.1805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2422 2.8516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 4.5234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5628 5.7159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3703 4.5085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7155 1.3661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2582 1.3756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7154 -0.3016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3671 0.8987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0449 3.7915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 M END