MMs00881854 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 1.1040 -1.0155 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0551 -1.3261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7765 -2.4793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8804 -3.4948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3119 -3.0465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6394 -1.5827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1327 -1.4418 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7282 -2.8186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6029 -3.8103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7438 -5.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5209 -6.1724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1075 -5.9284 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1920 -3.1460 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2075 -2.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7592 -0.6106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6714 -2.3696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7967 -1.3778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0877 -2.1416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7602 -3.6054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2668 -3.7463 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4644 -1.5461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7554 -2.3099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8807 -1.3182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2853 0.0586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7919 -0.0823 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5354 -0.5672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8124 0.8832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8832 0.8124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8124 -0.8832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3313 -2.0180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1298 -3.4902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 -4.2235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4325 -4.5603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2202 -7.1231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0858 -5.2334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5507 -4.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6840 -0.1831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8681 -3.5046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0518 -1.5801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8963 1.0914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9834 0.4983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4888 0.1615 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 2 4 1 0 0 0 0 2 27 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 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 21 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 M END