MMs01796934 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 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 1.4177 -0.4901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5509 0.4926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9686 0.0025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1019 0.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8175 2.4580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9508 3.4407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6663 4.9135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3684 2.9506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6528 1.4778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5196 0.4951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8040 -0.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2217 -1.4677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3549 -0.4850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0705 0.9878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7726 -0.9751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9059 0.0076 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.7544 0.8561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6215 1.4804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3236 -0.4825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6080 -1.9553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4568 0.5002 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2293 1.6784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8745 0.0101 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.5639 1.1692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1589 -1.4627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5766 -1.9528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8610 -3.4256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2787 -3.9157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0078 0.9928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7234 2.4656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3921 1.1341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1341 0.3921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3921 -1.1341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8346 -1.5389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3493 -1.2464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6193 1.2489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 1.5414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3856 -1.0463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9003 -0.7538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6833 2.8501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8974 -1.7638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4492 -2.6460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9771 1.7739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7997 1.7079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3939 2.6586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4432 1.2528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9591 -1.4822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9697 -2.6477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7658 -0.7678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7764 -1.9333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6612 -3.4450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6718 -4.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8866 -5.0498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4128 -4.3077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6708 -2.7815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4255 0.5027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.3321 1.2889 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 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 41 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 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 22 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 26 1 0 0 0 0 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 57 58 1 0 0 0 0 M END