MMs01368296 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 61 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 2.5980 -0.0154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3123 2.2423 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3123 3.4423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6158 2.9846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9104 2.2269 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2138 2.9692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2227 4.4691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5084 2.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8119 2.9538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1064 2.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0976 0.6961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6956 0.6807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7045 2.1807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4099 2.9384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 -0.0770 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.2325 -1.3715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7478 1.2176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2847 -0.8346 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5882 -0.0924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8828 -0.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0307 -2.3427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4961 -2.6633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2537 -1.3687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2567 -0.2481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0178 2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2857 2.2577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5803 3.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5714 4.5153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2679 5.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0267 4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5938 1.0428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0428 -0.5938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5938 -1.0428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9919 -1.0510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6337 -0.6215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2042 1.0203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8499 3.9084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3926 3.8992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9033 1.0269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5013 1.0115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8190 4.1537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0548 0.1023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3850 -1.2615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7472 2.7745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4170 4.1384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2776 -2.0346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8223 0.8315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3650 0.8223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1342 -3.1404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9776 -3.7624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4479 -1.2503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2928 1.0577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6230 2.4215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 5.1215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2608 6.4576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0694 5.0938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3035 0.7423 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 59 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 2 59 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 27 1 0 0 0 0 3 59 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 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 2 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 M END