MMs01362651 MOE2007 2D CORINA 3.40 0006 02.08.2006 65 68 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 -0.0120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2395 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7395 -1.3290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7603 1.2690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2603 1.2810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5207 2.5620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0480 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0118 1.4519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9878 -1.5480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 -0.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2393 -1.3650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7393 -1.3771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4997 -0.0841 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7601 1.2209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2601 1.2329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9996 -0.0961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7600 1.1969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7392 -1.4011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2391 -1.4131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9787 -2.7181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2183 -4.0111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4787 -2.7301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2390 -1.4371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7390 -1.4491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4786 -2.7541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7182 -4.0471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2182 -4.0351 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.4578 -5.3521 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.9483 -5.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2484 -6.9905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9434 -7.7301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8367 -6.7175 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.7746 -9.2206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9608 -4.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4995 -0.1321 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0096 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0096 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6312 -2.3514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3311 -2.3730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6687 2.3250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5550 1.9537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 3.5964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4863 3.1703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1085 -1.7664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4382 -2.5484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5215 -2.5571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8636 -1.7965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8910 1.6223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5612 2.4043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1358 1.6524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4780 2.4130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6083 -1.8025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9381 -2.5845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3473 -0.4147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6785 -2.7637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.3407 -7.4874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5822 -9.0856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6396 -10.4129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9670 -9.3555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.8462 -5.2243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.7709 -3.5289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.0755 -3.6041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 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 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 43 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 49 1 0 0 0 0 14 50 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 53 1 0 0 0 0 17 54 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 55 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 37 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 27 28 2 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 34 1 0 0 0 0 31 32 2 0 0 0 0 31 36 1 0 0 0 0 32 33 1 0 0 0 0 32 59 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 35 62 1 0 0 0 0 36 63 1 0 0 0 0 36 64 1 0 0 0 0 36 65 1 0 0 0 0 M END