MMs03076886 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 0.7586 1.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2585 1.2841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2414 -1.3139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7414 -1.3040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2413 -1.3337 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8413 -0.2945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7413 -1.3436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 -0.0496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4827 -2.6476 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9826 -2.6575 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.1826 -2.6575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6420 -1.3102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1064 -0.9850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2741 -1.9266 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.2642 -3.4265 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3034 -2.8265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6571 -3.9831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8705 -5.4685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6921 -6.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2991 -5.8400 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6097 -6.9991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0847 -4.3554 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6242 -4.0134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6816 -5.1803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1207 -6.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7278 -6.2115 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4827 -2.6278 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1655 2.3372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8654 2.3194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8345 -2.3571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1345 -2.3392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2993 1.1534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6302 0.3732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8758 -3.6828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4738 -1.0360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6493 -0.1103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5919 0.0991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0487 -0.2421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9024 -2.8084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8565 -4.0209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0105 -5.0938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4377 -6.5260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5870 -7.1960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0601 -7.4166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0758 -3.6709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3352 -8.2526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3924 -8.9951 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 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 30 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 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 25 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 28 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 30 49 1 0 0 0 0 50 51 1 0 0 0 0 M END