MMs01216945 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 1.3037 0.7419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9017 0.7257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4997 0.7096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5091 2.2095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0485 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0978 0.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2638 2.1842 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7330 2.4869 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4749 1.1832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4643 0.0748 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.9656 1.0171 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.8549 2.2252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3456 2.0591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2348 3.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7256 3.1010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3272 1.7269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4380 0.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9472 0.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8180 1.5609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7072 2.7689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5935 1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0429 -0.5935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5935 -1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5381 1.6659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0807 1.6563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -0.9306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3636 -0.9402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1361 1.6498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6788 1.6402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4190 -0.9468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9617 -0.9564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7866 -1.2485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7796 2.7579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1928 3.3766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7536 4.3664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4370 4.0674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9192 -0.5803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2358 -0.2814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.6736 2.0575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.4186 3.7353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7408 3.4803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 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 35 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 M END