MMs02973985 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 58 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 1.4195 -0.4847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7095 -1.9564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 -2.4412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2586 -1.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9686 0.0175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5491 0.5022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2787 0.7481 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3783 -0.2721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7478 -1.6332 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 0.0178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8370 -1.1117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3087 -0.8217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7934 0.5978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8064 1.7273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3347 1.4374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2651 0.8878 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.2521 -0.2418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7674 -1.6613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7238 0.0482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7108 -1.0814 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.1825 -0.7914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1695 -1.9209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6412 -1.6310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1259 -0.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1389 0.9181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6672 0.6281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6802 1.7577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6281 -2.7605 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 15.2260 -2.5009 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.8065 -2.0162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6456 -2.9856 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7413 -3.9204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3878 1.1356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1356 0.3878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3878 -1.1356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8059 -2.7460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 -3.6185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3171 1.6796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4492 -2.2473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0983 -1.7254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1942 2.8630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5452 2.3410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6529 2.0234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2909 1.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2373 0.3585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7817 -3.0566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.3033 0.0205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5267 2.0537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5839 2.5472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8907 2.6613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2284 1.3629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6057 -3.5326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3535 -5.0560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8769 -4.3082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 30 31 2 0 0 0 0 30 32 2 0 0 0 0 30 33 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 M END