MMs01355217 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 -0.7428 -1.3032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0144 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5144 -2.5897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2572 -1.2865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7572 -1.2782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5143 -2.5731 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1143 -1.5338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7716 -3.8762 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2716 -3.8846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5288 -5.1711 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2339 -5.9283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8236 -4.4139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2860 -6.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5432 -7.7691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3004 -9.0640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8004 -9.0557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5431 -7.7525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7859 -6.4576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5576 -10.3505 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.0143 -2.5647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7715 -3.8596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7571 -1.2616 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2571 -1.2532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 0.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2570 -1.2366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5143 -2.5398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0143 -2.5481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6058 1.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9428 -1.3098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5798 -3.6406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0942 1.0509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5422 -0.0976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8825 -0.8615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1463 -4.3012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4865 -5.0652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3432 -7.7758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7062 -10.1065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7431 -7.7458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3802 -5.4151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1513 -0.2257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6571 -0.2140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8700 0.4541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2017 1.2329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2849 1.2389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6252 0.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1720 -0.4601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1806 -2.0028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6441 -2.9439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3124 -3.7227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8889 -2.9648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2292 -3.7287 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END