MMs00111681 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.4569 -0.3572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8759 -1.7975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8382 -2.8805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2573 -4.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7141 -4.6780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7519 -3.5949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3328 -2.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1026 -4.2472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8997 -5.7334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4235 -5.9996 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9017 -7.0802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4243 -3.5378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6995 -4.3277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0211 -3.6183 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2963 -4.4082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2498 -5.9075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6179 -3.6989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8931 -4.4888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2148 -3.7794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2613 -2.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9861 -1.4902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6644 -2.1996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5829 -1.5707 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 16.8581 -2.3606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6294 -0.0715 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2858 1.1655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1655 0.2858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2858 -1.1655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3273 -2.5948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4271 -5.1873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1630 -1.2882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7661 -6.5636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6818 -2.5951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2238 -2.6429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -5.2226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4419 -5.2704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0583 -2.4189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8559 -5.6882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2349 -4.4113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0233 -0.2908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6443 -1.5677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 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 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 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 41 1 0 0 0 0 23 42 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