MMs01696391 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 -1.3035 -0.7422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3125 -2.2422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2855 -2.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2945 -0.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 -3.0156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8835 -2.2734 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1780 -3.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1690 -4.5311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4816 -2.2890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7761 -3.0468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0796 -2.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0886 -0.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4906 -0.7890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0624 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6499 1.2411 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1343 -1.3659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6956 0.6798 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 -0.0780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2937 0.6642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6603 0.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6707 1.1545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9285 2.4580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4594 2.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -4.4999 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0072 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3391 -0.1360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3553 -2.8359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3373 -0.1640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8032 -3.9302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3458 -3.9394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8907 -1.0734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7689 -4.2467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1152 -2.9108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8013 1.1532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4550 -0.1828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7028 1.8797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2133 -0.9926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7560 -1.0019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9027 -1.1294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8633 1.0219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4231 3.5513 0.0000 H 0 0 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 27 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 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 M END