MMs01807948 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 53 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 -0.7507 1.2986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0014 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4986 2.5989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2493 1.3003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7493 1.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6316 0.0881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 0.5524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0571 2.0524 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6303 2.5151 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2588 3.6562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2720 -0.3286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1160 -1.8205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6420 0.2823 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8560 -0.5987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2259 0.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4400 -0.8688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2840 -2.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9140 -2.9716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7000 -2.0906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4980 -3.2417 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.3790 -2.0277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6170 -4.4557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7120 -4.1227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.0820 -3.5118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2960 -4.3928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1401 -5.8847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7701 -6.4956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5561 -5.6146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2478 3.8984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5994 -1.0396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9507 1.2979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 3.6370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1006 -1.0381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2614 -1.0534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7667 1.4758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3507 1.2057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5359 -0.3801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7893 -4.1651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6040 -2.5793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4104 -2.5174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9448 -2.6778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8215 -3.3140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4497 -4.7230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4417 -7.4901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9074 -7.3297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4024 -5.2845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0306 -6.6934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6472 4.9373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 M END