MMs01032858 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 1.1256 0.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5471 0.5123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6727 1.5037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3769 2.9743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9555 3.4534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8299 2.4620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5026 3.9657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0496 4.4780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4711 3.9989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9189 2.5673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1547 1.2766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8905 -0.0306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3904 -0.0470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1546 1.2437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4188 2.5509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8980 3.9723 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0432 4.3306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6942 4.8672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7106 6.3671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0178 7.1029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7931 0.9005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9005 -0.7931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7931 -0.9005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7837 -0.6641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8098 1.1204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7189 4.6298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3073 2.8453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5651 4.7148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0775 5.0190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6246 5.5313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1122 5.2271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9548 1.2897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2791 -1.0632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9790 -1.0928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3545 1.2306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9240 3.4866 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1606 2.3102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4198 7.1313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4330 8.3313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 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 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 37 38 1 0 0 0 0 39 40 1 0 0 0 0 M END