MMs01366313 MOE2007 2D CORINA 3.40 0006 02.08.2006 66 68 0 0 0 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 -0.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5089 1.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4911 -1.5089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7422 -1.3213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2422 -1.3302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2576 1.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7577 1.2767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2421 -1.3480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2576 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7575 1.2411 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5153 2.5356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7730 3.8391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0152 2.5267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7729 3.8213 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0307 5.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5307 5.1337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7884 6.4371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5461 7.7317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0461 7.7228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7884 6.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8038 9.0174 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.2729 3.8124 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2818 5.3124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2640 2.3124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7729 3.8035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5151 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0151 2.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7728 3.7856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0306 5.0891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5306 5.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2728 3.7767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.0151 2.4733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0036 0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0036 -0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7089 1.4839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 2.6910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9089 1.4946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8911 -1.5053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4839 -2.7089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 -1.5160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1361 -2.3569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8360 -2.3730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8638 2.3035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1638 2.3195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6360 -2.3837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4421 -1.3552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6638 2.2928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3514 0.1983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7998 1.3462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1404 2.1096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2276 4.6159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5884 6.4443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9523 8.7745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9883 6.4122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9090 1.4644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6089 1.4483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6367 6.1248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9368 6.1408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9723 1.8795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.6089 1.4305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.0578 3.0671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 48 1 0 0 0 0 10 49 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 53 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 54 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 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 56 1 0 0 0 0 21 22 1 0 0 0 0 21 57 1 0 0 0 0 22 23 2 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 59 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 31 61 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 62 1 0 0 0 0 34 63 1 0 0 0 0 35 36 1 0 0 0 0 36 64 1 0 0 0 0 36 65 1 0 0 0 0 36 66 1 0 0 0 0 M END