MMs02681579 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 40 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 1.2951 -0.7568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6059 1.4864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9088 2.2296 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9151 3.4296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2039 1.4728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5069 2.2160 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8931 -0.7704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8853 -2.2703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4912 -0.7839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0892 -0.7975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7593 -0.6716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7688 0.4379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0256 1.7408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5567 1.4366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3108 2.2432 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0078 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0424 -0.5946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2888 -1.9568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7150 -1.6991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2577 -1.7072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0276 0.8825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5703 0.8745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3131 -1.7127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8558 -1.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7264 -1.3820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1539 -1.7077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5671 -0.4581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7433 1.1381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1244 2.2232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6607 2.8840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4376 2.6307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3568 1.4429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0282 2.1054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0543 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 19 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 20 37 1 0 0 0 0 M END