MMs02647959 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 -0.0081 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3112 -2.2429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2868 -2.2570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5899 -1.5141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8848 -2.2711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8767 -3.7711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5736 -4.5140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2787 -3.7570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1716 -4.5282 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3231 -5.3767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5453 -3.9255 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5429 -5.0456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0355 -4.8970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7858 -6.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3203 -6.0208 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8651 -2.4600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7558 -1.4503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0757 0.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5047 0.4710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6140 -0.5387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2942 -2.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0431 -0.0829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1523 -1.0927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0065 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0474 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9056 -1.2004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3537 -2.8373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7169 -3.2854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5964 -0.3141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4061 -1.9740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5671 -5.7140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2362 -4.3513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8794 -6.8346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4088 -7.4798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1842 -1.6326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1883 0.8230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7606 1.6434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1816 -2.8120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3629 1.3826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5062 1.7472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 17 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 36 1 0 0 0 0 15 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 40 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 42 43 1 0 0 0 0 M END