MMs03949311 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 0.7418 -1.3038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0164 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7253 -3.9018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2253 -3.9113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9835 -2.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2417 -1.3132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9671 -5.2150 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4671 -5.2245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2253 -3.9302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2088 -6.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7088 -6.5377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4670 -5.2435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4506 -7.8415 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9505 -7.8510 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3505 -8.8902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7087 -6.5567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2087 -6.5662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0827 -7.7853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5122 -7.3308 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4785 -8.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5217 -5.8308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0980 -5.3583 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6923 -9.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1923 -9.1642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4506 -7.8225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1924 -9.1263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9507 -7.8130 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2089 -6.5093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7089 -6.4998 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 0.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5934 1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -0.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2164 -2.5904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1188 -4.9372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1835 -2.6246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8483 -0.2778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9847 -5.5468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0736 -4.2081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4316 -4.6369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8440 -8.8769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1462 -6.3479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9246 -5.3763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7047 -8.9242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4969 -5.1316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3441 -8.8485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9341 -10.4490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5275 -11.4920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 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 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 24 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 30 2 0 0 0 0 47 48 1 0 0 0 0 M END