MMs00485219 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 54 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 -0.3942 -1.4473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8415 -1.0531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7884 -2.8945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0531 -1.8415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1181 -0.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7359 0.6653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5654 -1.1794 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6304 -0.1231 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9410 -1.2823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0777 -0.5174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1427 0.5389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5900 0.1447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9722 -1.3058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6550 1.2010 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1023 0.8068 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7917 1.9659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4845 -0.6437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9318 -1.0379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3140 -2.4884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7613 -2.8826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1673 1.8630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6146 1.4688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2482 1.3273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3132 2.3836 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1578 -0.3154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3154 1.1578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5789 0.1577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6838 -0.4742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9993 -0.7377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9992 -1.6320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3673 -2.7369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1038 -4.0524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3694 -3.2099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8712 -2.3398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5660 -1.6028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0578 -1.2097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1626 1.2313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6543 1.6244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3492 2.3614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2887 -0.7434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3750 -1.8387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0413 0.1571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1277 -0.9383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1182 -2.5880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2045 -3.6834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8708 -1.6876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9572 -2.7830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2915 -5.1781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1436 -4.3331 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.3014 -4.6485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7851 3.3135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8009 1.7215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4951 2.8819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6371 4.1585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 52 1 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 52 55 1 0 0 0 0 53 54 1 0 0 0 0 M END