MMs01949697 MOE2007 2D CORINA 3.40 0006 02.08.2006 35 35 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 0.7597 -1.2934 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2596 -1.2822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0193 -2.5756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5193 -2.5644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2596 -1.2598 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7595 -1.2486 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1595 -0.2094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5192 -2.5420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0192 -2.5308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7594 -1.2262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7788 -3.8242 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 0.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 0.0672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -3.8802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0387 -5.1736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7791 -3.8914 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0194 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4806 -2.6092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0388 -5.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0347 0.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6077 1.0347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0347 -0.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1270 -3.5991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6518 -0.2251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3947 -2.9608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7364 -3.7222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1866 -4.8679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9788 -3.8152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0049 -4.6038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5534 -6.2397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0825 -5.7882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7401 1.3494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3323 2.3931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 34 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 21 1 0 0 0 0 19 20 2 0 0 0 0 21 31 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 34 35 1 0 0 0 0 M END