MMs00746658 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 1.3045 -0.7405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3154 -2.2405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6199 -2.9810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6308 -4.4810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9134 -2.2216 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9570 -2.8140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9025 -0.7216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0189 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5893 1.2189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0219 -2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2826 -2.2594 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5762 -3.0188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8806 -2.2783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8915 -0.7784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1742 -3.0378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4786 -2.2973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7722 -3.0567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7612 -4.5567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0766 -2.3162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0876 -0.8162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3920 -0.0757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6856 -0.8351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6746 -2.3351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3702 -3.0756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5924 1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0436 0.5924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5924 -1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7999 -3.9135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7428 -3.9248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7981 -3.9325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3408 -3.9437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7140 -1.3724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2566 -1.3836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0527 -0.2087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4008 1.1243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7291 -0.2427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7095 -2.9427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3614 -4.2756 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 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 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 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 M END