MMs01532613 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 60 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 0.7419 -1.3037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2418 -1.3131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9837 -2.6168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4837 -2.6261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2418 -1.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7417 -1.3412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4836 -2.6449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9836 -2.6543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 -0.0562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2417 -1.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9835 -2.6730 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.5835 -1.6338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4835 -2.6824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2254 -3.9861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7253 -3.9955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4672 -5.2992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9672 -5.3085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7090 -6.6122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2090 -6.6216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9509 -7.9253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1928 -9.2196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6928 -9.2103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9509 -7.9066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9346 -10.5233 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.2254 -3.9673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 0.5935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5935 1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -0.5935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3772 -3.6522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0772 -3.6691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1064 1.0073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4064 1.0242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3534 -3.0483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6846 -3.8279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7678 -3.8347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1086 -3.0717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7988 1.1268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1300 0.3471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3748 0.3706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7156 1.1336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3718 -0.9660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0407 -0.1863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2825 -1.4993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6137 -2.2790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5243 -2.8124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8555 -3.5921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3370 -5.7025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6682 -6.4822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8155 -5.5862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.1509 -7.9328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0863 -10.2457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7510 -7.8991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8189 -5.0103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7417 -1.3599 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 11 58 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 58 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 14 58 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 29 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 27 56 1 0 0 0 0 29 57 1 0 0 0 0 M END