MMs01327841 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.3049 0.7397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3168 2.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0206 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3583 1.2724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8377 -1.3137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 -0.7809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8791 -2.2808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1722 -3.0411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4771 -2.3015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4890 -0.8015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8059 1.4381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0870 -0.8221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -0.0824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6850 -0.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6731 -2.3427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9900 -0.1031 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2830 -0.8633 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.2830 0.3367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2711 -2.3633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5642 -3.1236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8691 -2.3839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8810 -0.8839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5880 -0.1237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5999 1.3763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9048 2.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1979 1.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1860 -0.1443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5917 1.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -0.5917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5917 -1.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5168 2.2301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3264 3.4396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1169 2.2491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8352 -2.8726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1627 -4.2411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5116 -2.9097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2055 1.1587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6279 0.8429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1706 0.8307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9995 1.0969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0910 -2.1455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8518 -3.4876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7856 -4.0367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3282 -4.0489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2706 -3.5147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0525 -2.1849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5654 1.9845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9143 3.3159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2418 1.9474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2204 -0.7525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 M END