MMs01359678 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 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 1.0058 -1.1128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4725 -0.7981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4783 -1.9108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0175 -3.3383 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9449 -1.5961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9508 -2.7089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4423 -2.5492 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0550 -3.9184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5228 -4.2274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9422 -4.9242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6418 -4.1767 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.1897 -1.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6897 -1.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4423 -2.5434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4372 0.0546 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9372 0.0575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6897 -1.2400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1897 -1.2371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9372 0.0633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1847 1.3609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6847 1.3580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9322 2.6614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1797 3.9590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4372 0.0662 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1897 -1.2313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8902 0.8047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8047 0.8902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8902 -0.8047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0106 -1.7506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4575 -2.2245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3135 -0.4542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8356 -5.7255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2388 -5.8964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0613 -0.8405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3958 -0.0666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8352 1.0927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0917 -2.2804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7917 -2.2752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0827 2.3961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2178 4.5610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5777 4.9971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1416 3.3570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1517 -1.8334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7917 -2.2694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2278 -0.6293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 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 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 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 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 M END