MMs01128120 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 1.3054 -0.7389 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5852 1.5222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9034 -0.7166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0729 -2.2070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5428 -2.5063 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2816 -1.2009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2684 -0.0948 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7720 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6640 -2.2373 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0657 -3.6128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8597 -4.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2352 -5.1032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1544 -2.0678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0465 -3.2737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7528 -0.6923 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2432 -0.5227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1352 -1.7287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6256 -1.5591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2240 -0.1836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3319 1.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8415 0.8528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7143 -0.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8839 -1.5045 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 16.5448 1.4763 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 18.2047 0.1555 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5911 1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0443 0.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5911 -1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1881 -3.0176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4314 0.1193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8460 -0.4961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2248 -3.9234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9894 -3.6787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1972 -5.5054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4330 -5.1767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9549 -6.2700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0392 0.2725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6565 -2.8291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3392 -2.5239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8106 2.1227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1279 1.8175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 M END