MMs01587358 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 44 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 1.4860 0.2043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1942 1.5266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6706 1.2617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8749 -0.2243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5248 -0.8778 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1972 -0.9325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2451 -2.4318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4717 -0.1415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.8497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0684 -0.0586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0206 1.4406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3907 -0.7668 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6652 0.0243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6173 1.5235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8918 2.3145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2141 1.6064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2619 0.1071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9875 -0.6839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0353 -2.1832 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.8440 3.8138 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.3432 3.8616 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3447 3.7659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7961 5.3130 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4738 6.0212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0706 6.1041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1634 1.1888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1888 -0.1634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1634 -1.1888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6714 2.6067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5363 2.0927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0523 -1.7930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5942 -1.7438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4290 -1.9662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5595 2.0900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2337 2.2392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3198 -0.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0404 7.0790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4160 6.5878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9073 4.9634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7034 5.0845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0901 6.7369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4377 7.1236 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 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 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 38 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 26 43 1 0 0 0 0 M END