MMs00219188 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 60 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 1.1025 1.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 2.4804 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6045 3.0740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4657 4.5675 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9976 4.8970 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7632 3.6071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2568 3.4683 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1238 4.6924 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7238 5.7316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4972 6.0552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6173 4.5536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2439 3.1907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4843 5.7776 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9779 5.6388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6045 4.2759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0980 4.1371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9650 5.3612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3385 6.7241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8449 6.8629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4586 5.2224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3256 6.4464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0852 3.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8944 2.3084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2024 3.0427 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4923 2.2771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4743 0.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7642 0.0116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0722 0.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0902 2.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8003 3.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3982 2.9801 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -8.3621 -0.0197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8136 0.8820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -0.8136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8136 -0.8820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7507 0.0071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2097 1.4799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5875 6.5565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 7.1455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4069 5.5540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9831 6.8679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9109 3.2967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5993 3.0468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0321 7.7033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3437 7.9532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9949 3.3583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5864 2.7692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1755 4.3608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1121 1.3985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6547 1.3799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2169 4.2426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4279 0.1897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7497 -1.1883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8148 4.2113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9745 1.0122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3940 -0.6322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7496 -1.0516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 55 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 M END