MMs02004343 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 40 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 0.7574 1.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0148 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4852 2.6066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2426 1.3118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7426 1.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6311 0.1118 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0550 0.5834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0465 2.0834 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6173 2.5388 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2736 -0.2913 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.6404 0.3265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8589 -0.5482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7106 -2.0409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2257 0.0696 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.4442 -0.8051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8111 -0.1873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9594 1.3054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.3262 1.9233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5447 1.0485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3964 -0.4442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0296 -1.0620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.9116 1.6664 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.2278 3.9098 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5941 -1.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9573 1.2879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6206 3.6338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1059 -1.0273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9637 1.3175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4989 1.1650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3444 1.2637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5858 -1.6436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1209 -1.7962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9846 2.0052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4449 3.1174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.3712 -1.1440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9109 -2.2562 0.0000 H 0 0 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 28 1 0 0 0 0 4 5 2 0 0 0 0 4 25 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 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 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 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 M END