MMs01106518 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 57 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 -0.1639 -1.4910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0455 -2.3784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8816 -3.8695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4916 -4.4731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7009 -3.5857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5371 -2.0946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6554 -5.9641 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6947 -5.3641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4545 -6.9731 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0545 -5.9338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1621 -8.3405 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9970 -8.0299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9479 -9.3494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -10.8405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2505 -8.6056 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9455 -7.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9545 -6.0270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6179 -9.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7676 -10.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -11.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3527 -10.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2030 -8.9629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8356 -8.3463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6858 -6.8538 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.6531 -8.1766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 -6.7079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1068 -7.8068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6621 -6.4134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9077 -9.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3861 -9.3286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9058 -10.7357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9471 -11.8893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4687 -11.6358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 -10.2288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5556 -9.6734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2873 -10.4743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1928 -0.1311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1311 1.1928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1928 0.1311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -1.8956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8491 -4.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7995 -4.0685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5045 -1.3847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7934 -11.4154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2548 -12.5253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4466 -10.9486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1771 -8.2621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1531 -8.4057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0886 -10.9385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3629 -13.0150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7017 -12.5587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 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 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 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 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 26 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 36 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 49 1 0 0 0 0 32 33 1 0 0 0 0 32 50 1 0 0 0 0 33 34 2 0 0 0 0 33 51 1 0 0 0 0 34 35 1 0 0 0 0 34 52 1 0 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 M END