MMs02981629 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 1.4999 -0.0124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2607 1.2803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7607 1.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 -0.0373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5214 2.5606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0214 2.5482 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0089 1.0482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0338 4.0481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5213 2.5357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2605 1.2305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7604 1.2181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5212 2.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7820 3.8161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2821 3.8285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5429 5.1337 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.0429 5.1462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3036 6.4265 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 12.0211 2.4984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7819 3.7912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7603 1.1932 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2603 1.1807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9995 -0.1245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2387 -1.4172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7388 -1.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9996 -0.0996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2818 -1.1924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6241 -0.4322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3972 2.9804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7396 3.7406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6519 0.1963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3518 0.1739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3906 4.8503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0617 2.3642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3913 1.5818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9251 0.6392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9123 -0.9034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9373 -2.5883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6078 -1.8059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0868 0.6794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0740 -0.8633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 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 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END