MMs00884494 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 55 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 -1.2967 0.7541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2919 2.2541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0095 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3061 2.2459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3014 0.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8995 0.7377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 2.2377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0164 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0789 -1.5118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1763 -2.5344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6602 -2.3148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4142 -1.0181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8702 0.3794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4379 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5886 3.0082 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8900 2.2623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2584 2.8767 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2656 1.7651 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8656 2.8044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7338 1.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8953 -0.0334 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.3939 0.0302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6437 -1.3333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5269 -0.6478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5197 0.4637 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9197 -0.5755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0515 0.7710 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0038 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3378 0.1574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0132 4.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3472 2.8426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8238 -0.9250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3665 -0.9299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9333 -1.1547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4763 -2.5495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1833 -3.2081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6120 -3.6526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5671 -3.5112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8058 -2.6719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2914 -1.8370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4077 -0.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0573 0.5551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9629 1.5758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5605 1.6436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0406 1.8627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5848 4.2082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8555 2.6517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9338 1.4617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1302 -1.6851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5583 -1.3562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 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 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 2 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 M END