MMs02741174 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 1.5000 0.0024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2479 1.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4958 2.6005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2437 3.9008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7437 3.9032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4958 2.6054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7479 1.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0073 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7479 1.3100 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7521 -1.2881 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2521 -1.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1358 -2.4977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5616 -2.0319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5591 -0.5319 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1318 -0.0707 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7591 1.0700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7765 -2.9116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6222 -4.4036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8371 -5.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2065 -4.6710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3608 -3.1789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1459 -2.2992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4214 -5.5507 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2958 2.5986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 4.9390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 4.9434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6958 2.6073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9017 -1.0329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1538 -2.3283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7668 -3.6396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5267 -4.8935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7136 -6.4769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4563 -2.6891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2694 -1.1056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 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 34 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 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 M END