MMs01429582 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 -0.0062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2446 -1.3083 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0446 -1.3083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4893 -2.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2339 -3.9064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0247 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3999 1.0145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7553 1.2712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2553 1.2650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0106 2.5609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5106 2.5548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2553 1.2526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7552 1.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5106 2.5424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7660 3.8445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2660 3.8507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7742 4.9551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1420 4.3393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9791 2.8482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7446 -1.3269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0049 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0049 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2965 1.1764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6293 0.3996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5732 -1.8291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5669 -3.3718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6296 -4.9431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7132 1.1623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 0.3965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6294 1.6863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9685 2.4521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8847 2.9760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2239 3.7418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6510 0.2159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3510 0.2048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6703 4.8924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5176 5.4791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3148 4.0850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1403 -2.3636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7446 -1.3145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3403 -2.3562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 43 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 22 42 1 0 0 0 0 43 44 1 0 0 0 0 M END