MMs00877214 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 59 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 0.0091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2421 1.3126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4843 2.6071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0157 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7578 1.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2578 1.2854 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0156 2.5799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5156 2.5709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2577 1.2673 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7577 1.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5156 2.5527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0155 2.5437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7734 3.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2733 3.8291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0312 5.1236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5311 5.1145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2890 6.4090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5468 7.7126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7889 6.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5311 5.0964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0002 5.3994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1660 6.8902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7993 7.5086 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.7732 3.8019 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.3670 2.7591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2733 3.8110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5154 2.5165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7421 1.3217 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5937 -1.0428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1062 -1.0265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 3.6499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 3.6336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8905 2.9971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2311 3.7604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3144 3.7539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6457 2.9745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6250 -0.4444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2844 -1.2077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8699 -0.4217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2012 -1.2011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3904 2.9700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7311 3.7332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8000 1.3632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1407 2.1265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6482 4.2554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9889 5.0187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0578 2.6486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3985 3.4119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9060 5.5408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2467 6.3041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8871 4.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2088 7.4839 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 30 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 M END