MMs00683957 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 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 -1.4993 -0.0464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2087 -1.3681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4189 -2.6433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0804 -2.5968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7899 -1.2752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2891 -1.2288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2079 -2.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6195 -1.9070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5731 -0.4077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1328 0.0115 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7587 0.5111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1473 -0.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4225 0.7336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5330 2.2295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5677 -0.2351 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0003 -1.6237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7902 -2.8989 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5044 -1.5131 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.0246 0.1220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0623 -0.9611 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.3729 0.1980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7960 -2.4373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1176 -3.1467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2008 -2.1090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5485 -0.7582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 -1.4145 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5675 1.0573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1312 0.9737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9864 -3.7006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7123 -3.6170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8726 -3.5666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6117 -2.5819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5964 1.7001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5408 1.2202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0221 0.7891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6438 -2.1020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3421 -3.5481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4427 -4.1389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0338 -3.9217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9358 -3.0575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2209 -1.4771 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END