MMs02238019 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 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 -0.7441 -1.3024 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0117 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5117 -2.5913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2676 -3.8869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7676 -3.8801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5234 -5.1758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7793 -6.4782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0234 -5.1690 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6281 -6.2055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7675 -3.8666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0117 -2.5710 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5117 -2.5777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7558 -1.2821 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2558 -1.2889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2675 -3.8598 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2441 -1.3092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2441 -1.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4882 -2.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9882 -2.6116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7441 -1.3295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4882 -2.6319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 -0.0339 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 -0.0406 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.3999 0.9986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7440 -1.3430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2440 -1.3498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9881 -2.6522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2323 -3.9479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7558 1.2550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2558 1.2482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0419 -0.5953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5953 1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0419 0.5953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -3.0136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2254 -3.7789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6723 -4.9288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6512 -0.2524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8722 -4.8963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8628 -2.8179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4047 1.0284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1046 1.0162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0835 -3.6603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3836 -3.6481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9046 1.0081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6146 -1.7484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9471 -2.5257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0410 -0.1671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3735 -0.9445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4881 -2.6590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0116 2.5574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6163 3.5939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0834 -3.7009 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 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 15 2 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 40 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 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 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 32 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 32 33 2 0 0 0 0 32 53 1 0 0 0 0 52 55 1 0 0 0 0 53 54 1 0 0 0 0 M END