MMs00646988 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 1.2971 0.7533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8952 0.7600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8913 2.2600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2000 -1.4867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5009 -2.2334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7980 -1.4801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4933 0.7666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0913 0.7733 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5529 -1.4648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0209 -1.7729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6345 -3.1416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7676 -0.4719 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7610 0.6402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0691 2.1082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2589 -0.3113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8655 1.0605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3569 1.2212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2417 0.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6351 -1.3620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1437 -1.5226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7331 0.1705 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.4407 -2.4713 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6027 1.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0377 -0.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6027 -1.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5234 1.6706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0661 1.6745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1623 -2.0894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5040 -3.4334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8388 -2.0774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4902 1.9666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0882 1.9733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1577 2.0296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8422 2.3187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3429 -2.3310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6584 -2.6201 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 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 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 11 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 27 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 20 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 M END