MMs00029193 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 63 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 1.2971 0.7533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2933 2.2533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0066 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8952 0.7599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8914 2.2599 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1999 -1.4868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5009 -2.2335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7980 -1.4802 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0198 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7942 1.2198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4933 0.7665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0913 0.7731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0875 2.2731 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3846 3.0264 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.3454 3.6264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6856 2.2797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9827 3.0330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2837 2.2863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5808 3.0396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5770 4.5396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2760 5.2863 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9789 4.5330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3808 4.5264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0799 5.2731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6780 5.2797 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0990 -2.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3961 -1.4736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1028 -3.7269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8915 -4.6116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3586 -6.0370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8586 -6.0332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3185 -4.6055 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6026 1.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0377 -0.6026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6026 -1.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2579 1.3533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4933 2.2563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2903 3.4533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0933 2.2502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6011 -1.1934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0177 -1.2814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7924 -2.6155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7319 -3.1547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2746 -3.1508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 1.6838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2623 1.6877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0468 2.8705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9166 1.3585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4593 1.3624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2867 1.0863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6215 2.4423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6147 5.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4585 4.8317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1983 4.9810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6749 6.4797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7493 -4.2437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6558 -7.0096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5664 -7.0022 0.0000 H 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 4 1 0 0 0 0 2 39 1 0 0 0 0 3 40 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 43 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 46 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 26 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 23 24 2 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 25 56 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 31 35 1 0 0 0 0 32 33 1 0 0 0 0 32 59 1 0 0 0 0 33 34 2 0 0 0 0 33 60 1 0 0 0 0 34 35 1 0 0 0 0 34 61 1 0 0 0 0 M END