MMs00236768 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 61 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 1.4315 0.4480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5353 -0.5677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9668 -0.1196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2946 1.3441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7261 1.7922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8299 0.7765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5021 -0.6873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0706 -1.1353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7930 -1.4513 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9185 -0.4597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3233 0.9171 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3822 -0.7875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3980 0.3163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9499 1.7478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8617 -0.0115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8774 1.0923 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.3412 0.7646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7892 -0.6669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2530 -0.9947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2687 0.1091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8207 1.5406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3569 1.8684 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.7325 -0.2186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3277 -1.5955 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.7165 -2.6282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8211 -1.4549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9249 -2.4706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.3564 -2.0225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.6841 -0.5588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.5803 0.4569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1488 0.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8580 0.7729 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 26.1156 -0.1107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4602 -3.0382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3584 1.1452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1452 -0.3584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3584 -1.1452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8797 1.5136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3851 1.1766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4115 2.1567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9883 2.9632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8084 -2.3063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7407 -1.9327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4002 -1.1191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8724 -0.6583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9767 -1.5500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6114 -2.1399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6332 2.4236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.6627 -3.6416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.8425 1.6279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.4741 -1.2559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.2609 0.2477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.7572 1.0345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.6476 -3.9213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.3432 -3.8508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.2727 -2.1552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 43 1 0 0 0 0 10 11 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 44 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 45 1 0 0 0 0 16 46 1 0 0 0 0 17 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 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 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 49 1 0 0 0 0 24 25 1 0 0 0 0 24 33 2 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 35 1 0 0 0 0 30 31 2 0 0 0 0 30 34 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 34 52 1 0 0 0 0 34 53 1 0 0 0 0 34 54 1 0 0 0 0 35 55 1 0 0 0 0 35 56 1 0 0 0 0 35 57 1 0 0 0 0 M END