MMs02531292 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 64 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 0.0105 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3148 -2.2408 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3253 -3.7408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0315 -4.4999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6295 -4.4817 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6401 -5.9816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9443 -6.7225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2381 -5.9634 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2276 -4.4635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9233 -3.7226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5423 -6.7043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5528 -8.2043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8361 -5.9452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1403 -6.6861 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.4341 -5.9270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5804 -4.4342 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0454 -4.1120 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8045 -5.4058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8087 -6.5275 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1308 -7.9925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0231 -9.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3453 -10.4690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2376 -11.4805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2974 -5.5521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0564 -6.8459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5214 -6.5237 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.4188 -7.3204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6678 -5.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2932 -4.4304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1260 -2.9398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3333 -2.0496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7079 -2.6501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8751 -4.1407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0084 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1727 -1.2999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -2.6304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4569 -5.7816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2375 -7.1121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1794 -7.6472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7221 -7.6364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4108 -4.6636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6301 -3.3330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1455 -2.8088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6882 -2.7980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0583 -5.0314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6010 -5.0206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2402 -7.5352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7738 -9.0057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3801 -7.9908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9137 -9.4613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4284 -10.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3515 -12.2897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0468 -12.3666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5761 -7.9455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0263 -2.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1995 -0.8571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6737 -1.9380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9747 -4.6211 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 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 32 33 2 0 0 0 0 32 59 1 0 0 0 0 33 34 1 0 0 0 0 33 60 1 0 0 0 0 34 61 1 0 0 0 0 M END