MMs01235853 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 1.3922 -0.5582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5718 0.3683 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9641 -0.1899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3308 -1.6444 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8274 -1.7451 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3857 -0.3528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2341 0.6083 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8401 0.0139 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8850 -1.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4753 -2.5054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3394 -0.6957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3843 -1.7719 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.2328 -2.6205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9746 -3.2149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0194 -4.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6098 -5.7342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1553 -6.1009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1105 -5.0246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5201 -3.5816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8388 -1.4052 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.6746 -2.2662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2484 0.0377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2036 1.1140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7029 0.4045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7477 -0.6718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2022 -0.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6119 1.1379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5670 2.2141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1126 1.8474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4466 1.1138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1138 0.4466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4466 -1.1138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -1.5776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2861 -1.3589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1679 1.1683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8485 0.3993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3325 -0.0220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1830 -3.9978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4456 -6.5952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8276 -7.2552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9469 -5.3180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1022 -3.1511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4200 -1.8262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0381 -1.1661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7755 1.4312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8948 3.3685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2767 2.7084 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 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 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 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 M END