MMs02188696 MOE2007 2D CORINA 3.40 0006 02.08.2006 60 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 0.8129 -1.2606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3111 -1.1870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 -2.4476 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7240 -1.4084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6217 -2.5309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0052 -3.9811 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8537 -3.1325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5819 -3.8462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6612 -6.2916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4038 -4.5231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6337 -6.0054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5726 -3.5829 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9712 -4.1250 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.0105 -4.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1400 -3.1848 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1008 -2.5848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9101 -1.7025 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5995 -0.5434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0789 -0.7623 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.9274 0.0862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4775 -1.3043 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.6366 -1.6149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7074 -2.7866 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.0180 -3.9457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5386 -3.7268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1060 -3.3287 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.3359 -4.8110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6463 -0.3641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8490 0.7200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5115 -1.1604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2011 -5.6073 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5117 -6.7664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0323 -6.5475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5997 -6.1493 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0085 0.6503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6503 1.0085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0085 -0.6503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2932 -1.7259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0791 -2.4307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0449 -0.0169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4172 -0.7217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5627 -1.3324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8075 -2.3470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5145 -3.2980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9251 -4.8505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4631 -6.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5946 -7.4898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8594 -6.3583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3887 -2.3971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1501 -4.9949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5198 -5.9968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5217 -4.6271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4624 0.8217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7301 1.1537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3276 0.0254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2802 -5.6125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0973 -7.2997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7845 -7.4825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7446 -4.7940 0.0000 N 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 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 60 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 9 60 1 0 0 0 0 10 47 1 0 0 0 0 10 48 1 0 0 0 0 10 49 1 0 0 0 0 10 60 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 50 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 32 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 31 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 29 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 34 57 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 M END