MMs02742114 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 -1.5000 -0.0008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2507 1.2978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5014 2.5973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0014 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7493 1.2994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7479 3.8975 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7507 1.2970 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 -0.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8823 1.2098 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3087 0.7455 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3079 -0.7545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8810 -1.2172 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4167 -2.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4198 -3.7588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9555 -5.1852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4881 -5.4962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4851 -4.3810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9493 -2.9546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0239 -6.9226 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -9.5209 -1.6368 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.8916 -1.0274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1046 -1.9098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4753 -1.3004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6006 -1.0389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0994 -1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 3.6362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9493 1.3001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3513 2.3359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3721 -0.4122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7077 -1.1843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5937 -3.5100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7580 -6.0774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3111 -4.6298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1469 -2.0624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2211 -0.0322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7552 -0.1943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9470 -3.4015 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 M CHG 1 39 -1 M END