MMs00488913 MOE2007 2D CORINA 3.40 0006 02.08.2006 35 35 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 1.3027 -0.7436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3102 -2.2435 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3102 -3.4435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0148 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2879 -2.2564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0223 -4.4999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2731 -5.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6129 -2.9871 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9082 -2.2307 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1518 -0.9354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6646 -3.5260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2035 -1.4743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5062 -2.2178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8016 -1.4614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4914 0.7821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0894 0.7950 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5949 1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0422 0.5949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5949 -1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3027 0.4564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9006 -0.5053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6343 0.6180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9929 1.0491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8782 -4.2201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3093 -5.8615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6679 -6.2926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6188 -4.1871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5122 -3.4178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8437 -2.0563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4855 1.9821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1539 0.6206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 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 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 M END