MMs01147936 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 61 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 1.3022 0.7446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9002 0.7337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4983 0.7229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0326 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0963 0.7120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1026 2.2120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0434 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5437 -0.8919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5428 -1.5358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0087 -1.8538 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.7641 -0.5579 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3641 -1.5972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7651 0.5610 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0831 2.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5116 2.4844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9725 3.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2905 4.5011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1800 5.5095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7515 5.0519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4335 3.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5440 2.5777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6410 6.0602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2565 -0.4074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8723 0.9604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3648 1.1109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2414 -0.1063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6256 -1.4740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1331 -1.6246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7338 0.0443 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5957 1.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0417 -0.5957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5957 -1.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5347 1.6670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0773 1.6606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8229 -0.9269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3656 -0.9333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1327 1.6562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6754 1.6497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4209 -0.9377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9636 -0.9442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7308 1.6453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2734 1.6389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7891 -1.2325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3428 -1.5308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4124 -2.7287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4333 4.8672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4344 6.6822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2907 3.2199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2896 1.4049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4477 6.9487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7526 6.8669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8343 5.1718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1711 1.9341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8574 2.2051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3268 -2.4478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6405 -2.7188 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 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 58 1 0 0 0 0 31 59 1 0 0 0 0 M END