MMs01672086 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 1.4858 0.2057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5256 -0.8754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8751 -0.2206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6694 1.2652 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1927 1.5287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5379 2.8782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3793 4.1201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0418 2.9859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 4.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1981 -0.9275 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4718 -0.1353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4225 1.3639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7948 -0.8422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0685 -0.0499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3915 -0.7568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4407 -2.2560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6652 0.0354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1260 -0.3050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4664 1.1559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0056 1.4963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2621 -2.3521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8515 -2.8622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4092 -3.3186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1457 -4.7953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1646 1.1887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1887 -0.1646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1646 -1.1887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4667 4.8593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1368 5.4151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6926 3.8116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2375 -2.1269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0541 -1.7863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5959 -1.7356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9757 -1.1237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8537 -1.4737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2947 -0.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6351 0.8835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7388 2.3246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8369 1.7686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2779 2.6650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9644 -4.5845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9349 -5.9766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3270 -5.0061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 6 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 10 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END