MMs01215368 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 -1.2954 0.7563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 0.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6053 -1.4874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3099 -2.2437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0072 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9079 -2.2312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2033 -1.4749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5060 -2.2186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8014 -1.4624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7941 0.0376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1040 -2.2061 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3994 -1.4498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5490 0.0427 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.0147 0.3616 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.7710 -0.9338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7727 -2.0533 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -14.2635 -1.0834 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -14.8802 -2.4507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3727 -2.6003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.2485 -1.3826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.7411 -1.5322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.3578 -2.8995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.4820 -4.1173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.9894 -3.9677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1136 -5.1855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.2378 -6.4032 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0421 0.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2896 1.9562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6344 0.6175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3157 -3.4437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0291 -2.1050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1410 -3.1541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6837 -3.1467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7391 -3.1416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2817 -3.1342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1098 -3.4061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7173 -2.7467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9697 -3.6474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.7552 -0.2887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.4417 -0.5579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.5518 -3.0192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.9753 -5.2112 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 28 1 0 0 0 0 2 3 2 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 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 27 3 0 0 0 0 M END