MMs00656728 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 53 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 0.8438 1.2401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1918 2.5910 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9013 3.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1363 4.9958 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4871 4.3437 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2844 2.8575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3676 1.8199 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8078 2.2392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8911 1.2016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5341 -0.2553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3313 1.6209 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4145 0.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8547 1.0026 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.5441 -0.1565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3620 2.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8613 2.3679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2806 0.9277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0404 0.0839 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3876 4.1153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4252 3.0320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 3.6841 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8333 3.1164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5733 5.1703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0972 5.4368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5899 6.8484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5587 7.9936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0348 7.7271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5421 6.3155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9921 0.6751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6751 -0.9921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9921 -0.6751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7036 0.4031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8175 1.9415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2774 3.3156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7758 2.9484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6168 2.7864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4465 -0.1260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9449 -0.4931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1965 2.6998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5242 3.6032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7727 3.5647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0422 2.5811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3914 1.3818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8482 -0.1295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 1.8511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4089 7.0616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1528 9.1229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8099 8.6432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7230 6.1023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 M END