MMs02748099 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 1.5000 0.0070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2439 1.3096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7439 1.3166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 -1.2815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2561 -1.2885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0281 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0070 -1.4719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9929 1.5281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 0.0351 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2438 1.3377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7438 1.3447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4877 2.6472 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9877 2.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7316 3.9568 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3316 2.9175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1151 5.3242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2251 6.3331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5276 5.5892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2226 4.1206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2560 -1.2604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7560 -1.2534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5121 -2.5489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7681 -3.8514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2682 -3.8584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5121 -2.5629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5242 -5.1610 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.5242 -5.1469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0056 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0056 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 2.3460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3390 2.3586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3609 -2.3179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6609 -2.3305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1143 1.7428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4467 2.5204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8829 3.6836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7849 1.4715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1172 2.2491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0787 4.7194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4052 6.2917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3296 7.1319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9259 7.3072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0106 6.6877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6706 5.2237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0535 -0.7324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7120 -2.5433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3121 -2.5685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4878 -5.7518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1291 -6.1833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5606 -4.5421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 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 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END