MMs01058275 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 1.4875 0.1935 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2052 1.5106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7067 2.9254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6826 4.0645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1571 3.7888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6556 2.3741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6797 1.2350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8732 -0.2525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5183 -0.8961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2427 -2.3706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3818 -3.3465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1903 -0.9702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7876 -0.9062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0678 -0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0308 1.3751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3110 2.1569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6281 1.4391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6651 -0.0604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3849 -0.8422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9822 -0.7782 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.1548 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -0.1548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1548 -1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5271 3.1459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2838 5.1963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9378 4.7001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8352 2.1536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4419 -1.9082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9841 -1.8702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5814 -1.8062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0391 -1.8442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9771 1.9493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2814 3.3565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6522 2.0646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4145 -2.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -2.8691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4705 -0.1884 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4409 1.0112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6075 -4.0487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 36 1 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 M END