MMs01880248 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 39 0 0 1 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 -0.7557 -1.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0114 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 -1.2891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0114 -2.5848 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6114 -3.6241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5114 -2.5782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2557 -1.2759 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 -3.9533 -0.5316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9999 0.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 0.0330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2442 1.3354 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.8442 2.3746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7442 1.3420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4999 0.0463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5580 -2.0202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5633 -3.2202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2671 -3.8872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7672 -3.8938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0366 -0.6046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6046 1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0366 0.6046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4443 -1.2957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0533 -3.1935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -3.6399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0304 -2.0026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0421 -0.1083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3815 -0.8737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3082 -3.7609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6408 -2.9837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8705 0.4319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2031 1.2091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2968 -1.1496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6294 -0.3724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4885 2.6443 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.4885 2.6311 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.4519 2.0265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8839 3.6677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5251 3.2357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0229 -5.1829 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 18 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 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 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 36 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 16 17 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 M CHG 1 35 -1 M CHG 1 36 1 M CHG 1 40 -1 M END