MMs01164545 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 -1.3008 -0.7469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3045 -2.2469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6053 -2.9937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9025 -2.2406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8989 -0.7406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 0.0126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3493 1.5047 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8158 1.8201 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5689 0.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5679 -0.5942 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.0611 0.3697 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9398 1.5854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3264 2.9542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4320 1.4322 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.8320 0.3929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0454 0.0633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3107 2.6478 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.8029 2.4946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4163 1.1258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.6816 3.7103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0682 5.0791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9470 6.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4391 6.1416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.0525 4.7727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1738 3.5571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.5447 4.6196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -19.4234 5.8352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5975 -1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0407 0.5975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5975 1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2667 -2.8494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6082 -4.1937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9432 -2.8381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5952 1.2063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5518 -0.7254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1405 0.5541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5361 -1.0317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9503 -0.4274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8200 3.7429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8745 5.2017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4562 7.3898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.1421 7.1141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6645 2.4620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.4509 6.5382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.1264 6.8077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.3960 5.1322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 36 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 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 M END