MMs03947743 MOE2007 2D CORINA 3.40 0006 02.08.2006 60 61 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 1.5000 0.0018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2515 -1.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2485 1.3017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7485 1.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 2.6033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9970 2.6051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7485 1.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2485 1.3087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9970 2.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2454 3.9068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7454 3.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9939 5.2067 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2424 6.5048 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4424 6.5048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7424 6.5031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9909 7.8012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4909 7.7995 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7394 9.0976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9909 7.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2394 9.1029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4970 2.6103 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2485 1.3122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 0.0123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7485 1.3139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 0.0158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0000 0.0175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7485 1.3174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9970 2.6156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4970 2.6139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0014 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0014 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -1.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -1.8976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8527 -2.3349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 -0.6952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8957 3.6419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2964 3.1251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6012 -1.0315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9012 -1.0347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8497 0.2702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1939 5.2081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9522 5.3216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6153 6.0913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1180 8.2130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7811 8.9828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7779 9.6989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1382 10.1362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7008 8.4964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0957 3.6503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9012 -1.0242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6012 -1.0210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9485 1.3188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5957 3.6555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8957 3.6524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4909 7.8065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0897 8.8464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 59 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 59 60 1 0 0 0 0 M END