MMs01050728 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 2.2481 -1.3022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7481 -1.3044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7518 1.2937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2518 1.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7481 -1.3086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2481 -1.3108 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9963 -2.6109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2444 -3.9089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4963 -2.6130 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6963 -2.6130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2444 -3.9131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4926 -5.2111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2407 -6.5112 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9406 -7.2593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5408 -5.7630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9889 -7.8113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2481 -1.3150 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6400 0.0561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7561 1.0582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7583 2.5582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0584 3.3064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3563 2.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3542 1.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0541 0.3064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7401 -1.1604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7423 -2.2765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0017 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0017 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4548 -2.4843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1199 -1.7111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5381 -2.4858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8752 -1.7164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5451 2.4758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8801 1.7025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4619 2.4773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1248 1.7079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1282 0.4003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7933 1.1735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6199 -1.7175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9548 -2.4907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8496 -0.2724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1648 -3.1431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1626 -4.6858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5744 -4.4384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5722 -5.9811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9488 -8.4098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5874 -8.8514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0290 -7.2128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5999 -0.5424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9360 1.0280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7199 3.1597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0601 4.5064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3964 3.1531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3926 0.4531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.0021 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0064 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 58 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 58 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 59 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 59 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 58 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 6 59 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 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 54 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 24 25 2 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 M END