MMs00050780 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 1.3325 0.6888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5584 2.1717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0385 2.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7274 1.0826 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 0.0157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7116 3.7556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2091 3.8429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8822 5.1834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0579 6.4366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5604 6.3493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8873 5.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3898 4.9214 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.0334 2.5897 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4915 3.2261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8712 4.6773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9551 2.8294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0219 3.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6422 5.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7091 6.3893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1557 5.9926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5354 4.5414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4685 3.4870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8482 2.0359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2948 1.6391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1957 5.7317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 7.1828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5511 1.0660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -0.5511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5511 -1.0660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0802 5.2533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5963 7.5090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9009 7.3518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4054 7.5502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0092 6.8361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6927 4.2240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6122 2.7964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4521 1.3217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9774 0.4819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2311 5.3099 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 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 14 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 40 1 0 0 0 0 M END