MMs01888004 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 -1.3018 -0.7452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3074 -2.2451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6092 -2.9903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9055 -2.2355 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8999 -0.7355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 0.0194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3473 1.5117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8134 1.8291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5682 0.5328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5687 -0.5856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8860 -2.0517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0606 0.3816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9377 1.5984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3225 2.9664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8302 3.1177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1997 4.1832 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.6920 4.0320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5692 5.2488 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.3072 2.6640 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.4301 1.4472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0453 0.0791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.7996 2.5127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2289 2.5113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5961 -1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0415 0.5961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5961 1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2704 -2.8490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6137 -4.1903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5936 1.2097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2974 2.9271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0589 -1.7978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1399 -3.2245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7132 -2.3055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5528 -0.7128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7075 5.2777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9206 3.7066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9935 2.3918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6786 1.3189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4293 1.6165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3341 3.3109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0285 3.4060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 37 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 24 1 0 0 0 0 22 23 2 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END