MMs01573842 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 1.3035 -0.7423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9015 -0.7268 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1872 1.5308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4995 -0.7114 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7852 1.5463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0976 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 0.0617 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.6956 -0.6805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8612 -2.1714 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3303 -2.4745 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0726 -1.1710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0623 -0.0623 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.5634 -1.0054 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.4523 -2.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9431 -2.0480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8320 -3.2563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3228 -3.0906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9247 -1.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0359 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5450 -0.6741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5938 1.0428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0428 0.5938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5938 -1.0428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5376 -1.6661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0803 -1.6569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8212 0.9301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3639 0.9393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9086 -1.9268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5067 -1.9114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3317 -1.6198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8744 -1.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0450 0.0937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3768 -2.7461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7899 -3.3652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3504 -4.3554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.0339 -4.0572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.1174 -1.5842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5174 0.5907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8339 0.2925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 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 34 1 0 0 0 0 10 35 1 0 0 0 0 11 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 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 M END