MMs01281435 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 1.3050 -0.7396 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2658 -1.3396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -0.7188 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9150 -2.2188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 -2.9791 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5828 -3.5791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.2395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 -4.4791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0415 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9563 -1.2515 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4356 1.3345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4890 0.8019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4770 2.3019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7700 3.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0750 2.3226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0870 0.8227 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 10.3680 3.0830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3560 4.5830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6730 2.3434 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9660 3.1038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9540 4.6037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2470 5.3641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5520 4.6245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5640 3.1246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2710 2.3642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2830 0.8642 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5917 1.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 0.5917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5917 -1.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8193 0.9338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 0.9462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0950 -2.0009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3344 -3.3431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -4.4887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6436 -5.6790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8339 -4.4695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4330 2.8935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7604 4.2622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1310 0.2310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8036 -1.1376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6826 1.1435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9100 5.1954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2374 6.5641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5864 5.2328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6080 2.5329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 M END