MMs01698936 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.4999 0.0128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 -1.2797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2388 1.3183 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8388 2.3575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4777 2.6108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2166 3.9162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4555 5.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0445 5.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7833 3.8906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0222 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2833 3.8777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0444 5.1703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3055 6.4757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8056 6.4885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7387 1.3311 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 0.0385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7610 -1.2669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 0.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7609 -1.2412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2608 -1.2284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 0.0770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2386 1.3696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7386 1.3568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4996 0.0899 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0103 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0103 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8999 -1.0264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -1.8886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8699 -2.3138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2951 -0.6709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4165 3.9265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0465 6.2531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6133 1.5537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9570 4.3911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9702 5.9337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4366 6.8764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1073 7.6592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3298 2.3754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1698 -2.2855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8697 -2.2624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8297 2.4139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1298 2.3908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 16 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 M END