MMs00337214 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 54 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 0.1621 -1.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5346 -2.0964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7450 -1.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5829 0.2808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2104 0.8860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 0.8958 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1963 2.0705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9587 -0.2153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2133 -1.5170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4499 -0.0531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0551 1.3193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5463 1.4815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8271 -1.1014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3359 -1.2635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9235 0.4333 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3235 1.4725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6688 1.7350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1372 1.4284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2483 2.4360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2993 -0.0628 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9312 -0.6779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6246 -2.1462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6010 -0.8082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6064 -2.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9081 -3.0535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2045 -2.2989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1991 -0.7989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8974 -0.0535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4954 -0.0442 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 0.4842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8062 -2.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6643 -3.2894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0807 2.0790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8499 0.9861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8897 1.6055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1345 2.5167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2114 2.6338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6229 2.0114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7477 -2.2987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9925 -1.3875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2592 -1.7934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6708 -2.4158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5709 2.2191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0356 2.8776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5693 -2.9119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9124 -4.2535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2458 -2.8951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8931 1.1465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4323 0.2711 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 50 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 16 50 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 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 30 1 0 0 0 0 29 49 1 0 0 0 0 M END