MMs02655222 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 -0.7611 1.2926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 1.2798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2388 -1.3182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7389 -1.3054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4998 -0.0384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2609 1.2541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5220 2.5595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7608 1.2413 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5219 2.5339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7830 3.8393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7959 5.3393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4905 4.6004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4997 -0.0641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9997 -0.0769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7607 1.2157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7385 -1.3823 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2385 -1.3951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1305 -0.1891 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.5531 -0.6648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5403 -2.1648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1098 -2.6161 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 2.3369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8699 2.3138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8299 -2.3625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -2.3395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2814 -1.2184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6239 -0.4585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4345 1.7548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4477 3.2974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9422 4.1499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9794 5.5375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3951 6.4704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7113 3.6878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7270 5.5262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3686 -0.4648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6980 -1.2476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1297 -2.4163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5299 0.0322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5050 -2.8784 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 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 40 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 M END