MMs00164829 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 -1.2962 0.7549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2906 2.2549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0113 3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3075 2.2451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3019 0.7451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6094 2.9902 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9056 2.2353 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6605 3.5315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1507 0.9391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2018 1.4804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5036 2.2255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7998 1.4706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4923 -0.7745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0904 -0.7843 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3979 1.4608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6884 -0.7940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6828 -2.2940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9790 -3.0489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2808 -2.3038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2865 -0.8038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9959 1.4510 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 15.5770 -3.0587 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0045 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3377 0.1588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3275 2.8588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3388 0.1412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6139 4.1902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5081 3.4255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8413 2.0667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4878 -1.9745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1546 -0.6157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0859 -1.9842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6413 -2.8901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9745 -4.2489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3280 -0.2078 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 30 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 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 27 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 M END