MMs01269296 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 52 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 1.3007 0.7471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3041 2.2471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0058 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5588 -0.6058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5947 -1.5058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8988 0.7412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1928 -1.5117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4969 0.7354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0175 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0949 0.7295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0983 2.2295 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3990 2.9766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4024 4.4766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7031 5.2237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0005 4.4707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9971 2.9707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6964 2.2237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6930 0.7237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0234 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3889 -1.5234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0882 -2.2705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0848 -3.7705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3821 -4.5234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6829 -3.7763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6862 -2.2763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9802 -4.5292 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5977 1.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0406 -0.5977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5977 -1.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2615 1.3471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5041 2.2444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3068 3.4471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1041 2.2498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3947 -1.5031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5920 -2.7058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7947 -1.5085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9015 1.9412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7276 1.6564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2703 1.6529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3645 5.0789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7058 6.4237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0411 5.0684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0350 2.3684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0503 -1.6681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0442 -4.3681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3794 -5.7234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7268 -1.6787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 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 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 50 1 0 0 0 0 M END