MMs00096096 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 0.7563 -1.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2563 -1.2881 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6563 -0.2488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0126 -2.5834 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8126 -2.5834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -3.8861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -3.8934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5126 -2.5761 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2689 -3.8715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7689 -3.8642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7672 -2.7446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1404 -3.3480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9909 -4.8405 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 -5.1596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7816 -6.4622 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2816 -6.4695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5253 -5.1742 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4481 -1.2789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5580 -0.2698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2390 1.1959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8101 1.6525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7003 0.6433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0193 -0.8223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0363 0.6051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6051 1.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0363 -0.6051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3693 -1.7113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9705 -2.4761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0421 -0.5803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5949 1.0568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9578 0.6095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -2.0551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1767 -2.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6866 -7.5117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7010 -0.6351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1268 2.0032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5549 2.8250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5572 1.0086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5754 -1.2260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0253 -5.1815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4303 -6.2236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 42 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 19 2 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 42 43 1 0 0 0 0 M END