MMs00891640 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 55 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 0.6066 -1.3719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0731 -1.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2261 -3.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5948 -3.7932 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8106 -2.9146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6576 -1.4224 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2888 -0.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1358 0.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8733 -0.5438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2421 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3951 -2.6496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4579 -0.2788 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8266 -0.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9796 -2.3846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3484 -2.9982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5642 -2.1196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4111 -0.6274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0424 -0.0138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8894 1.4784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1051 2.3570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8542 -3.7863 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1467 -2.6690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6388 -2.8220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2524 -4.1908 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5174 -1.6062 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0096 -1.7592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8882 -0.5435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3882 -0.5397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8481 0.8881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6324 1.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4211 0.8819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0975 0.4853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4853 1.0975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0975 -0.4853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9056 -3.4055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0122 0.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5469 0.4493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3355 0.9149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0070 -3.0875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4708 -4.1919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6592 -2.6104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3838 0.0755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8080 1.3844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0777 3.0598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4023 3.3296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0266 -0.5112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6818 -2.9136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0895 -2.2826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0960 -1.5087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9884 1.2618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6293 2.9667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 23 2 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 31 2 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 M END