MMs01107519 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 63 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 1.5000 -0.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2424 -1.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7424 -1.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4848 -2.6241 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9848 -2.6329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7423 -1.3382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2423 -1.3469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9848 -2.6503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2272 -3.9449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7273 -3.9362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9697 -5.2483 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.4847 -2.6590 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2272 -3.9623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7272 -3.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4847 -2.6764 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7422 -1.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2423 -1.3643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9847 -2.6851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7271 -3.9884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7422 -1.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2422 -1.3991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9997 -0.1045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2572 1.1989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7573 1.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9997 -0.0870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0148 2.4936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.5147 2.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2723 3.7795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7722 3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2985 1.1743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 0.3952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1124 -1.7159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4439 -2.4950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8788 -3.6599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1484 -0.2955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8483 -0.3112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1212 -4.9720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0972 -4.3662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4287 -5.1453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5119 -5.1516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8524 -4.3880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8722 -0.9691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5407 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1170 -0.9473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4575 -0.1838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8361 -2.4418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1997 -0.1114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1633 2.2503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7998 -0.0801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2995 1.3043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6400 2.0679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1470 4.1965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4875 4.9601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.7653 2.5708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.9722 3.7639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.7792 4.9708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 42 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 M END