MMs01271951 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 -0.7404 -1.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0191 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5191 -2.5870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2595 -1.2825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 -1.5835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8967 -3.0741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5309 -3.6943 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2901 -4.8699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8363 -0.5717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2662 -1.0247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3735 -0.0128 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8035 -0.4658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1261 -1.9307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9108 0.5460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3408 0.0930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4481 1.1049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1254 2.5698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6955 3.0228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5881 2.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1582 2.4639 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 13.8780 0.6519 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.4250 -0.7781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3310 2.0818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3080 0.1988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.4153 1.2107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8452 0.7577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1679 -0.7072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0606 -1.7191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6306 -1.2661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6076 1.0348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9404 -1.3133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5732 -3.6416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0923 1.0546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9403 -3.6665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8853 0.1602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3918 0.4920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7107 -2.0883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2172 -1.7565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1154 1.1591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5989 -1.0789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0113 3.3793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4373 4.1947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4643 1.9425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9708 2.2744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0035 1.9472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0442 0.8084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2772 -0.2495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8112 -1.7202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0116 -2.4509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5050 -2.7827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4317 -1.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4724 -2.4556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 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 23 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END