MMs02301636 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 1.2962 -0.7549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8943 -0.7647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8886 -2.2647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4980 0.7255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7885 -1.5294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0847 -2.2843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3866 -1.5392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0960 0.7157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6828 -2.2941 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.6771 -3.7941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9846 -1.5490 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.4510 1.2822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 1.2879 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2059 2.5784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4608 3.8803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2157 5.1765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9412 -1.3215 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1863 -2.6177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9314 -3.9195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6039 1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 0.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6039 -1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5214 -1.6712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0641 -1.6771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7301 1.6476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2728 1.6418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7470 -2.1255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0802 -3.4843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4337 0.5568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1006 1.9156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5387 3.1124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5445 4.6551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2527 4.5726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8197 6.2135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1788 5.7804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1412 -1.3260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5863 -2.6154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END