MMs01087619 MOE2007 2D CORINA 3.40 0006 02.08.2006 66 66 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 0.7565 -1.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5388 -2.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -2.5905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0518 -0.5388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3545 -1.2823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 -2.7823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6498 -0.5258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9526 -1.2693 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9526 -0.0693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2478 -0.5128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2403 0.9872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5506 -1.2563 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8459 -0.4998 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.8459 -1.6998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1487 -1.2433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4439 -0.4869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7467 -1.2304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0420 -0.4739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0345 1.0261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7317 1.7696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4364 1.0131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8384 1.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5356 1.7436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1337 1.7566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1262 3.2566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9601 -2.7693 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2628 -3.5128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5581 -2.7563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2703 -5.0128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5731 -5.7563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3166 -4.4535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8759 -6.4998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8296 -7.0590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0362 0.6052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6052 1.0362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5181 -0.3026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8414 -1.5336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 -2.6569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2362 -2.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9949 -2.8931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1181 -3.6268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5492 -1.9854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8739 0.3896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4165 0.3973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5536 -1.8563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3819 -2.1664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9246 -2.1587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7527 -2.4303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0842 -1.0687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0707 1.6313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7257 2.9696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9153 1.3105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3262 3.2626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1202 4.4566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9262 3.2506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9238 -3.3745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8377 -4.7509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9114 -3.4113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2744 -3.8587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5785 -7.0209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9181 -7.0946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1733 -5.9787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7874 -6.4642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2348 -8.1013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3507 -7.3564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 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 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 34 66 1 0 0 0 0 M END