MMs03590964 MOE2007 2D CORINA 3.40 0006 02.08.2006 65 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 0.7394 -1.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2394 -1.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0211 -2.5980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6211 -3.6372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -2.5858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2605 -1.2808 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2815 -3.8787 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7815 -3.8666 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9815 -3.8666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5209 -2.5615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5420 -5.1595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0419 -5.1473 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8025 -6.4646 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7184 -3.9031 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2183 -3.9152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9788 -2.6223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9578 -5.2203 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7578 -5.2203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1973 -6.5132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9367 -7.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4366 -7.8305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1761 -9.1355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4156 -10.4285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9156 -10.4163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1762 -9.1112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4577 -5.2325 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2182 -3.9396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4788 -2.6345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7182 -3.9517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4787 -2.6588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7716 -3.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1858 -1.8983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2392 -1.3659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0441 0.5916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5916 1.0441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0441 -0.5916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3394 -0.2658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2297 -2.5172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4394 -1.3270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2491 -0.1173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 -4.9228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4769 -1.9699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1125 -1.5174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5650 -3.1531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4110 -7.4989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6026 -6.4743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -4.9374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2843 -5.7344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2718 -7.2771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0451 -6.7961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3761 -9.1453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0071 -11.4725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3072 -11.4506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9762 -9.1015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0493 -6.2765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1632 -4.4536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8059 -4.0277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0758 -2.9022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4900 -1.3811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1514 -1.2899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5774 -2.9326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7564 -1.6701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8476 -0.3316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7220 -1.0617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 15 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 27 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 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 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 M END