MMs00516535 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 62 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 1.4885 -0.1850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5132 0.9105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8717 0.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2533 0.8586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4499 -0.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2649 -1.5344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8833 -2.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6867 -1.2140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2138 -1.4980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7051 -2.5848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8316 0.5382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0282 -0.3663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4098 0.2177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5948 1.7063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9764 2.2903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1730 1.3858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9880 -0.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6064 -0.6868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2291 2.3834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8116 2.8738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5275 4.3467 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 4.8371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0235 3.8547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 6.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5916 6.8004 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 8.2356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5278 8.2640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0182 6.8464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8216 5.9419 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4533 6.4100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3863 9.4940 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.1235 9.4322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 1.1908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1908 0.1480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -1.1908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4013 2.0495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2222 -2.2580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7353 -3.3093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1493 -1.1834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6802 -1.3737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6375 2.4299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1244 3.4812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2783 1.8531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9453 -0.8263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4584 -1.8776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 2.4025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4186 3.5683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6221 1.6889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3883 2.8547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4344 5.1326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0258 6.3292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9846 7.4949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8025 7.5580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6014 6.0608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1042 5.2619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1662 8.7086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3999 10.3895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0808 10.1558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 27 28 2 0 0 0 0 27 33 1 0 0 0 0 28 29 1 0 0 0 0 28 32 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 M END