MMs01346255 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 -0.7613 -1.2925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2612 -1.2794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 0.0261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4998 0.0392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2611 -1.2532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5225 -2.5588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0225 -2.5718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2839 -3.8774 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.7611 -1.2402 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4997 0.0654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7384 1.3578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9997 0.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7383 1.3840 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.2383 1.3970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9769 2.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5010 4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7068 5.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9279 4.1462 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -13.4768 2.7156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2381 1.4232 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.4995 0.1176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9995 0.1046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.2308 6.4398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7309 6.4267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2798 4.9961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -0.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 1.0340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 0.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3909 1.0601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0908 1.0836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1315 -3.5927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3701 -2.2741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8016 -1.1051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1308 -0.3222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1085 -0.9163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4024 6.6995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0950 7.6320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8459 7.6212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5550 6.6659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6889 3.9517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1793 5.4746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 23 2 0 0 0 0 16 17 1 0 0 0 0 16 20 2 0 0 0 0 17 18 2 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END