MMs01454180 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 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 -0.7402 -1.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0197 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5196 -2.5867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2598 -1.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7293 -1.5827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8974 -3.0733 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2911 -4.8694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5317 -3.6938 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8364 -0.5706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5134 0.8942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2664 -1.0234 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3735 -0.0113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8036 -0.4640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9107 0.5481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5877 2.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6948 3.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1249 2.5723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4478 1.1075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3407 0.0954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2320 3.5844 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.2199 4.6915 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2441 2.4773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3391 4.5965 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6078 1.0347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9401 -1.3138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5725 -3.6417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0921 1.0551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5248 -2.1952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4224 0.7204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9289 1.0525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2483 -1.5278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7548 -1.1956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4437 2.3751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4365 4.1969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5919 0.7453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5991 -1.0765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4831 4.2343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0807 5.7684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 10 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 M END