MMs03331191 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 -1.3047 -0.7401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3161 -2.2400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0229 -2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2819 -2.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2933 -0.7599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3889 -3.2720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7684 -4.6376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2778 -4.4695 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5319 -5.3551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8585 -2.9713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8536 -4.0936 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7022 -4.9422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3792 -5.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3744 -6.6390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3232 -3.7930 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 -2.3699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2671 -2.0693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2623 -3.1916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7879 -4.6146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7318 -2.8909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2062 -1.4679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6758 -1.1672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6710 -2.2896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1966 -3.7126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7270 -4.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1405 -1.9889 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0091 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3393 -0.1322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3599 -2.8321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3371 -0.1678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3604 -5.6814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4174 -1.8553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8809 -2.3432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6466 -0.9309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0014 -1.4721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1193 -4.6908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4101 -0.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0553 -0.0288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9927 -4.6104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3475 -5.1517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9097 -5.8173 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 38 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 27 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 M CHG 1 42 -1 M END