MMs02039796 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 47 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 -0.6086 1.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1002 1.5294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9832 0.3168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3746 -1.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -1.2126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4748 0.4752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2234 1.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6910 1.4648 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5819 2.2687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8494 -0.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4797 -0.6384 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1492 -0.7754 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.4475 -0.0240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7473 -0.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0455 -0.0212 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.3454 -0.7697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3470 -2.2697 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.6436 -0.0183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6420 1.4817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.9435 -0.7669 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -17.2417 -0.0155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.2401 1.4845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.5383 2.2359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.8381 1.4873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.8398 -0.0127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.5415 -0.7641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.5432 -2.2641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.5448 -3.7641 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1933 -0.1267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0978 2.3410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5871 2.6262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0810 -2.0242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3961 -2.3094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7342 2.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6751 0.8944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2178 0.8961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9770 -1.6927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5197 -1.6910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0442 1.1788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9448 -1.9669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.2002 2.0834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.5370 3.4359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.8767 2.0884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.8797 -0.6116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 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 5 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 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 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 41 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 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 28 29 3 0 0 0 0 M END