MMs01762339 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 13.5485 0.7582 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 13.1176 3.1467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7960 2.4373 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 13.2628 -0.4073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6778 0.3522 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 14.9358 3.0575 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 12.4427 4.1389 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