MMs00290909 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 1.1767 -0.9303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9594 -2.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1361 -3.3447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5301 -2.7908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7474 -1.3066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5707 -0.3764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2260 -1.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9226 -2.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8745 -3.4561 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1265 -4.9348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9719 -5.8923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5653 -5.3712 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4214 -2.4440 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2236 -1.1766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5270 0.1519 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0282 0.2128 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7223 -1.2375 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5245 0.0300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0233 -0.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7199 -1.3594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8254 1.2365 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3242 1.1755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6526 1.8721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5917 0.3734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7442 0.9414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9414 0.7442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7442 -0.9414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1558 -2.8576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9623 -4.5321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7445 0.8110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2564 -4.5308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7205 -5.9774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4145 0.4859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7807 1.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2682 2.2993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0136 2.3347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2884 3.0155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8419 2.0323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1358 -0.7367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7640 0.1171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2239 -7.3710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3002 -8.1371 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 5 10 1 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 17 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 42 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 42 43 1 0 0 0 0 M END