MMs02593361 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 1.2115 -0.8845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0512 -2.3759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2626 -3.2605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6344 -2.6536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7946 -1.1622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5832 -0.2776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8458 -3.5381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2176 -2.9312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5148 -3.6843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6681 -5.1764 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6319 -2.6832 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0250 -1.3115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5329 -1.4647 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.7781 -0.0142 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2781 -0.0177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0250 -1.3185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5250 -1.3220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2780 -0.0248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5311 1.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0311 1.2796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2842 2.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2719 -2.6228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7719 -2.6263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7076 0.9692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9692 0.7076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7076 -0.9692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0462 -2.8614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1344 -4.4536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 -0.6767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7114 0.9155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7176 -4.7312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1805 1.0265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4226 -2.3563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4780 -0.0276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1335 2.3139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3248 3.1779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6866 3.6210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2435 1.9828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5189 -3.9201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1165 -4.9607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 14 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 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 33 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 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 40 41 1 0 0 0 0 M END