MMs01004657 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 1.2981 -0.7517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8961 -0.7550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4942 -0.7583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0923 -0.7617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0904 -2.2617 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3942 1.4866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0962 2.2383 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0977 3.4383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7962 1.4900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4981 2.2416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6942 2.2350 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9923 1.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2923 2.2316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5904 1.4800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2884 -0.7684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 -0.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6904 -0.7650 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.8904 2.2283 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.1884 1.4766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1865 -0.0234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.4884 2.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4904 3.7249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7904 4.4733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0885 3.7216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0865 2.2216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7865 1.4733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6013 1.0385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0385 0.6013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6013 -1.0385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5255 -1.6699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0682 -1.6719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8279 0.9169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3706 0.9149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1236 -1.6733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6663 -1.6753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 0.9136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9687 0.9116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7217 -1.6766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2644 -1.6786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2938 3.4316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6269 -0.6214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2869 -1.9684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8919 3.4283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4519 4.3263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7919 5.6733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.1285 4.3203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.1250 1.6203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7850 0.2733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 23 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 16 17 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 46 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 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 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 M END