MMs00234456 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 40 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 1.4931 0.1436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 -1.0777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8571 -0.9341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4793 0.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6084 1.6520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1153 1.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9724 0.5743 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9662 -0.5492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6414 -2.0136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3419 0.0487 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3419 -1.1513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1983 1.5418 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7339 1.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1360 3.2423 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6343 -0.7128 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9399 0.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9532 1.5257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2588 2.2641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5511 1.5027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5379 0.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2322 -0.7357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2189 -2.2357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9133 -2.9742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1149 1.1945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1945 -0.1149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1149 -1.1945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8662 -2.1696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5538 -1.9111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1062 2.7439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4186 2.4855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6236 -1.9127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9193 2.1348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2694 3.4641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5956 2.0934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5717 -0.6065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5113 -2.9972 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5007 -4.1971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 14 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 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 37 1 0 0 0 0 37 38 1 0 0 0 0 M END