MMs01087724 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 59 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 1.3373 -0.6795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5736 -2.1607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0554 -2.3937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7349 -1.0564 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 0.0030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7379 -3.7294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2359 -3.8063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9184 -5.1420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1029 -6.4009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6049 -6.3241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9224 -4.9884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4243 -4.9116 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.0515 -2.5473 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5142 -3.2226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -4.6710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9352 -2.8360 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9946 -3.8979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6048 -5.3463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6642 -6.4082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1136 -6.0216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5034 -4.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 -3.5113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1730 -7.0835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6223 -6.6969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6818 -7.7587 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.9924 -6.5996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1311 -7.3721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6399 -8.0474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6994 -9.1093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0298 -6.5990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2919 -9.2072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5436 1.0698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0698 0.5436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5436 -1.0698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1169 -5.2034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6489 -7.4695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9524 -7.3313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2471 -1.6773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4453 -5.6556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3523 -7.5669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6629 -4.2639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7559 -2.3525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1164 -5.6087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6061 -6.0097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6252 -6.2840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1149 -6.6850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7990 -7.7368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5489 -8.2617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5469 -9.9588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8499 -9.9568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8710 -6.2871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3417 -5.4402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1885 -6.9109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1395 -10.0567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1906 -8.4340 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8787 -9.5928 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 14 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 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 32 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 48 1 0 0 0 0 29 56 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 55 1 0 0 0 0 56 57 1 0 0 0 0 M END