MMs01271043 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 1.5000 0.0090 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 3.7577 -1.2766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7422 1.3214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2422 1.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7576 -1.2587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2576 -1.2497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1465 -2.4579 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5279 0.2252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5703 -1.9859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5614 -0.4859 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1320 -0.0309 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7891 -2.8603 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.1557 -2.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3745 -3.1164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2266 -4.6091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7412 -2.4981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9599 -3.3726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3266 -2.7543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4745 -1.2616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2557 -0.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8890 -1.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8411 -0.6433 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.0072 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0072 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6639 -2.3284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3639 -2.3122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3359 2.3642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 2.3481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6325 -1.6758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9731 -2.4392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4788 -1.2512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0140 -1.4033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8416 -4.5667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3016 -3.4538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3740 0.8070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9140 -0.3059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 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 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 13 2 0 0 0 0 12 14 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 M END