MMs01507098 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 54 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 -1.2930 0.7604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 2.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 2.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 0.7396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 0.7189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1840 -1.5415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 0.6981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5130 2.1981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8179 2.9377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1109 2.1773 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0990 0.6774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4159 2.9169 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.1555 1.6119 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6763 4.2219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7209 3.6565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7329 5.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0379 5.8961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3309 5.1357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3189 3.6358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0139 2.8962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6119 2.8754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9169 3.6150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9289 5.1150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6359 5.8753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 3.0207 0.0000 Br 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 -2.3370 0.1687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0335 4.1999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 2.8312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 1.6442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6816 1.6319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3296 1.9991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1115 3.3289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0540 3.8630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5966 3.8507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2824 0.8763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5004 -0.4535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0153 -0.9753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5580 -0.9876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6985 5.7647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0475 7.0960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0043 1.6962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3183 2.4841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1003 3.8139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1090 4.8971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3483 6.2393 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 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 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 29 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M END