MMs02771866 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 54 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 1.5000 0.0071 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 3.7438 1.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7561 -1.2814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2561 -1.2884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5122 -2.5910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0122 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7317 -3.9006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0244 -5.1961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2316 -3.9077 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0282 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0070 -1.4718 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9929 1.5282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 0.0353 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2560 -1.2602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7560 -1.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5121 -2.5486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7682 -3.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2682 -3.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5121 -2.5628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5243 -5.1467 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0243 -5.1396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7682 -3.8371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7804 -6.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0365 -7.7377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7926 -9.0332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2926 -9.0261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0365 -7.7236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2804 -6.4281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4877 2.6192 0.0000 Cl 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 0.0028 -0.6000 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 4.3610 -2.3178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1136 -2.0067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1173 -2.1929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8365 -2.8713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8267 -4.9497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0950 1.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3511 -0.2111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7121 -2.5430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6731 -4.9003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3122 -2.5684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9292 -6.1887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8366 -7.7433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1975 -10.0752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8975 -10.0625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2365 -7.7179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8755 -5.3860 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 26 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 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 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 31 52 1 0 0 0 0 M END