MMs01596984 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 40 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 -0.7579 1.2944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2579 1.2853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 -1.3127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7421 -1.3036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3742 -1.2463 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7878 1.4079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8036 -0.7915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8127 0.7085 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3890 1.1807 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0117 -1.6805 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.3857 -1.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5938 -1.9678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4280 -3.4586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9678 -1.3661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1337 0.1247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5077 0.7264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7159 -0.1626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5500 -1.6534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1760 -2.2552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.0899 0.4391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.2980 -0.4499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.1321 -1.9407 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -18.6720 0.1518 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1642 2.3373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8642 2.3209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8357 -2.3556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1357 -2.3391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7208 -0.0799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2540 -0.2505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1672 0.8359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6404 1.9191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5165 -2.3647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0433 -3.4478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.3372 -1.0499 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 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 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 10 2 0 0 0 0 9 11 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 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 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 38 1 0 0 0 0 M END