MMs01037282 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 1.5000 0.0095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2417 1.3133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4835 2.6075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7417 1.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7416 1.3418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9834 2.6360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4834 2.6265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7252 3.9208 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.7581 -1.2562 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2581 -1.2467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 0.0570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0163 -2.5410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5163 -2.5315 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3902 -1.3124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9177 0.1112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8197 -1.7669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1140 -1.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4177 -1.7504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4272 -3.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1330 -4.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8292 -3.2669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4056 -3.7394 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.7011 -5.2100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2459 -4.6908 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0076 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0076 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9065 -1.0145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9416 1.3494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5768 3.6791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1647 -2.2993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8913 -2.9586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2321 -3.7214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1064 0.1913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4531 -1.1439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4703 -3.8438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1406 -5.2086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 M END