MMs03075642 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 55 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 0.7532 -1.2972 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4468 -1.2972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0065 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4935 -2.6018 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2403 -3.9027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 -5.1999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7403 -3.9064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2532 -1.2934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0065 -2.5906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0075 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3865 1.3763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4987 2.3827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7996 1.6360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4914 0.1680 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6505 0.4786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4978 -0.9442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0379 -2.3720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9643 -0.6287 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9708 -1.7409 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2813 -0.5818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5108 -3.1687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5173 -4.2809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9837 -3.9653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9902 -5.0776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5302 -6.5053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0638 -6.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0573 -5.7086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4372 -1.4254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8972 0.0023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5189 0.3013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6026 1.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0377 -0.6026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1351 -3.0057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -3.7804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7433 -2.7065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9403 -3.9094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7373 -5.1064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8676 1.0750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6787 2.3453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6049 3.1835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2016 3.3553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2849 2.7334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9418 1.2680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3323 0.5135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4499 -2.6079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7744 -4.1161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1677 -3.3942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1633 -4.8251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3354 -7.3951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6958 -7.9630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8841 -5.9610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4437 -2.5376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6168 -2.2852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 29 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 53 54 1 0 0 0 0 M END