MMs01017525 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 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 1.5000 -0.0074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2436 -1.3101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7436 -1.3174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4872 -2.6201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7308 -3.9155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4744 -5.2182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9744 -5.2255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7308 -3.9302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9872 -2.6275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7435 -1.3322 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2435 -1.3395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9871 -2.6422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0442 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 -0.0515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3756 -1.2694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8044 -0.8129 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8118 0.6871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3875 1.1576 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.0296 1.5628 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.3969 0.9460 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 16.4362 0.3460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6148 1.8217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4653 3.3143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0980 3.9311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8802 3.0554 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.8802 4.2554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5129 3.6722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5464 -0.5465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0059 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0059 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2974 1.1754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6296 0.3975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5308 -3.9096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8693 -6.2545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5693 -6.2677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9308 -3.9361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1487 -0.2900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4050 0.9980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1355 0.7406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7699 2.1468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6620 3.2247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7613 4.4772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7739 4.9226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2389 4.7689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0063 4.7660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4190 4.1656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0194 2.5783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3524 -0.6661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6660 -1.7406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7404 -0.4270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 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 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 40 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 41 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 21 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 30 1 0 0 0 0 24 25 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 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END