MMs03589536 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 -1.5000 -0.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2451 -1.3074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4903 -2.6037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0097 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7548 -1.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2354 -3.9055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7354 -3.9111 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4806 -5.2129 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1788 -5.9581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7824 -4.4678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2257 -6.5147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7169 -6.6771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0233 -8.1455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7215 -8.8906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6105 -7.8828 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4806 -5.2017 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8806 -6.2409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2257 -6.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9709 -7.8054 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0194 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9056 -6.4063 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -7.5490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3304 -5.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6323 -6.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9285 -5.9278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9229 -4.4278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6211 -3.6827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3248 -4.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8965 -3.9793 0.0000 N 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 -2.1039 1.0314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4451 -1.3119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3116 -3.1166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9548 -1.2918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5232 -5.7883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1177 -8.6376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5916 -10.0836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6367 -7.8826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9700 -6.5239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9599 -3.8239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6166 -2.4827 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 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 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 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 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 19 20 3 0 0 0 0 21 22 1 0 0 0 0 21 30 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 39 1 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 27 28 2 0 0 0 0 27 41 1 0 0 0 0 28 29 1 0 0 0 0 28 42 1 0 0 0 0 29 30 1 0 0 0 0 M END