MMs02626591 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 44 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 1.5000 0.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2577 -1.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5154 -2.5891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2732 -3.8836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7577 -1.2767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7422 1.3213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7576 -1.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2576 -1.2499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 0.0536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2421 1.3481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7421 1.3392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9844 2.6338 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.0153 -2.5444 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5153 -2.5355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2575 -1.2320 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2730 -3.8301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7730 -3.8211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5307 -5.1157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5152 -2.5177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0071 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0071 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2846 1.1894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6251 0.4261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0577 -1.2856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5916 -1.8232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6008 -3.3659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2375 -4.4898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8793 -4.9193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3088 -3.2775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1638 -2.3016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1998 0.0607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8359 2.3909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4215 -3.5872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9730 -3.8211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4951 -5.7219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1369 -6.1513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5663 -4.5095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5580 -3.1115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1090 -1.4749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4724 -1.9238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 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 4 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 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 14 2 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 M END