MMs01388629 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 49 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 0.8084 -1.2635 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3068 -1.1952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1323 0.0572 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5785 -0.3408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8421 0.4676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1739 -0.2225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2422 -1.7209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9787 -2.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6469 -1.8393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2429 -2.3673 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.5741 -2.4110 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8376 -1.6026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7693 -0.1041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1695 -2.2926 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3210 -3.1412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3941 -3.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8740 -4.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5459 -5.3615 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5640 -2.6886 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.5106 -1.6207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0471 -2.4640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5942 -1.0673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6581 0.1048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2052 1.5015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6883 1.7261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6243 0.5540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0773 -0.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0108 0.6467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6467 1.0108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0108 -0.6467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7874 1.6663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1847 0.4242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0334 -3.7281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6288 -3.6097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1953 -3.8304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3231 -4.9736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8639 -0.6099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4483 -0.8719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0180 -3.6636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2235 -2.7010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4716 -0.0749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4563 2.4392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1259 2.8434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8108 0.7336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8261 -1.7804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 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 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 M END