MMs01231728 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 35 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 0.7608 1.2927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0216 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4783 2.6105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2391 1.3177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4999 0.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2175 3.9157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7174 3.9282 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4782 2.6355 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9782 2.6480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7173 3.9532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7389 1.3552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1403 -0.0201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2633 -1.0145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1478 -2.2089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5561 -0.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2320 1.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3383 2.2238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7687 1.7722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0928 0.3076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9865 -0.7054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5913 -1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9608 1.2828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6303 3.6322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4391 1.3277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1086 -1.0217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6088 4.9499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8869 1.5913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9686 -0.2794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0790 3.3955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6538 2.5825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2371 -0.0537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2457 -1.8770 0.0000 H 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 20 2 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 M END