MMs01168936 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 59 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 1.5000 -0.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2547 1.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7547 1.2854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7453 -1.3127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2453 -1.3072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8772 -1.2385 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3055 -0.7802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3109 0.7198 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0004 1.8789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8860 1.1885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5277 1.5971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8957 0.9820 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1125 1.8592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9611 3.3516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5930 3.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4416 5.4590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6584 6.3363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0265 5.7212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1778 4.2288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5459 3.6138 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.5070 7.8286 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.0471 -0.5104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8304 -1.3876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4152 -1.1255 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.5666 -2.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0589 -2.4664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7179 -4.1101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0742 -2.7692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0044 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0044 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6585 2.3323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3585 2.3224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3415 -2.3541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6415 -2.3443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8490 1.7923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3781 2.2830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6675 2.4338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2023 2.5895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6346 0.7788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2672 2.1858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6196 3.2649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3472 5.9511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9998 6.4230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3886 -0.4236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1195 -3.0634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2528 -2.3453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9378 -1.2725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1210 -4.1707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8390 -5.3040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3149 -4.0496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9531 -1.5753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8804 -2.8903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1348 -3.3661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 31 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 M END