MMs02890998 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 -0.8105 -1.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0727 -0.4516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6211 -2.5243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4516 -2.0727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7846 -1.3849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8555 0.1134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0468 -2.1955 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3798 -1.5077 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0692 -2.6668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3381 -0.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4840 0.9597 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9549 0.6656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7654 1.9278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2637 1.8569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9515 0.5238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1410 -0.7383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6426 -0.6674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0305 -2.0378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5776 -2.4106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2835 -3.8815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9976 -3.1845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4880 -4.5953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0115 -4.8594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0097 -0.6484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6484 1.0097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5049 0.3242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7485 0.0533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0824 0.1968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3969 -0.9565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -2.2001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2695 -3.5340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6114 -3.1727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9901 -3.3941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1761 -0.3079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7873 1.0578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2152 2.9942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9122 2.8666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1502 0.4671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6912 -1.8047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7666 -2.2633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0383 -3.7819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4550 -5.7419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0474 -6.8706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 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 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 43 44 1 0 0 0 0 M END