MMs02069389 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.2958 0.7556 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8939 0.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2026 -1.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9068 -2.2332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6045 -1.4888 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4919 0.7779 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0900 0.7891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0835 2.2891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0447 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6880 0.8003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9967 -1.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2990 -2.1885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5948 -1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2861 0.8114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2796 2.3114 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.8874 2.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1832 3.0223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5852 3.0111 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2894 2.2556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0129 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5787 4.5111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6045 1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0366 -0.6045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6045 -1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2444 -2.0732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9119 -3.4332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0268 -0.8891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5694 -0.8824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3974 -1.1553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9127 1.7162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4554 1.7228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9601 -2.0486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3041 -3.3885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6366 -2.0285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6250 0.6715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7787 4.5163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5735 5.7111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3787 4.5060 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 25 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 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 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 2 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 M END