MMs00035858 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 65 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 1.0809 1.0400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.3334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1409 -1.1433 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6551 -1.3494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7534 0.9886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8608 2.4847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2101 3.1398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4522 2.2988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3448 0.8026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9955 0.1475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4471 -0.2147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0097 -1.6495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9295 0.0147 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6839 -1.2817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1839 -1.2766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9301 0.0262 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1757 1.3226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6757 1.3175 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.2757 2.3567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1236 2.7122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1399 3.8154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6884 3.1483 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4301 0.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1757 1.3329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1846 -1.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6846 -1.2600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8623 0.2294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3337 0.5207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0654 -0.7887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0462 -1.8893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9849 -2.5868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7842 -3.8562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2831 -3.7987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1814 0.2105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 2.2287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0898 -2.4079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8671 3.1575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2960 4.3368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9096 -1.0494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5577 -1.6960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8964 -2.4628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9796 -2.4591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3130 -1.6831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3019 1.7369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9633 2.5037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5049 4.3342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0584 -1.6794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3970 -2.4462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6624 0.2463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7536 1.4245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9789 1.6671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4367 0.9934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0461 -0.0971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8558 -1.6917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4317 -2.9200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0070 -2.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0368 -1.8513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0959 -3.3928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0845 -5.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7239 -6.1985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 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 24 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 26 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 31 1 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 33 34 2 0 0 0 0 33 60 1 0 0 0 0 60 61 1 0 0 0 0 M END