MMs00998119 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 1.4827 -0.2271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7098 1.2556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9654 -0.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2556 -1.7098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -2.2545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4261 -2.6479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 -2.2523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6963 -3.5061 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7583 -4.6766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3552 -4.1462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1943 -5.0961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4365 -6.5764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8396 -7.1068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0005 -6.1569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1947 -3.5770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0052 -2.3148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3174 -0.9818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5035 -2.3857 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3141 -1.1236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8124 -1.1944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6230 0.0677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1213 -0.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8091 -1.3362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3074 -1.4071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1179 -0.1449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4302 1.1881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9318 1.2590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6163 -0.2158 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0908 0.5931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1862 0.1817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1817 -1.1862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3029 1.1648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8915 2.4418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1167 1.3464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7837 -1.6404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1516 -0.6359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0563 0.1389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2973 -1.1298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0719 -4.6717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5078 -7.3363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0333 -8.2911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1230 -6.5813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9307 -4.7476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3016 -4.0402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0538 -3.4521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2071 -0.6603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5781 0.0470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5484 -2.3650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9194 -1.6577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1606 -2.3459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8576 -2.4735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0786 2.1978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3816 2.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 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 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 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 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 M END