MMs03264455 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 47 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 1.3039 -0.7415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9019 -0.7245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4901 0.7925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7843 1.5509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7744 3.0509 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0685 3.8094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3725 3.0679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3823 1.5679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0882 0.8095 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8119 1.1137 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6856 2.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7960 3.5407 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2847 -0.3098 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.1332 0.5388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7143 -0.7640 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.8734 -1.0745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7241 -2.2639 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.7241 -3.4639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3006 -2.7368 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.1006 -2.7368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4110 -1.5290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8464 -4.1664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8574 -5.2745 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4940 -6.4182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0295 -5.0173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3812 -4.4878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9434 -3.1377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0364 -2.6424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9220 0.1256 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.0587 5.3094 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5932 1.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0431 0.5932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5932 -1.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5386 -1.6658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0813 -1.6557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8207 0.9312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3633 0.9413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1366 -1.6488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6793 -1.6387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8856 2.3409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0940 5.9161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0156 5.9025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 3 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 24 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 32 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 29 2 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 30 31 1 0 0 0 0 33 44 1 0 0 0 0 33 45 1 0 0 0 0 M CHG 1 32 -1 M END