MMs02734899 MOE2007 2D CORINA 3.40 0006 02.08.2006 65 68 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 0.7606 1.2928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0535 0.5322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5322 2.0535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5213 2.5857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0212 2.5734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7818 3.8662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0425 5.1714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5426 5.1837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7819 3.8908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8031 6.4642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0638 7.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3031 6.4519 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0637 7.7448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5637 7.7325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3030 6.4273 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5424 5.1345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0424 5.1468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8029 6.4150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5422 5.1099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0422 5.0976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8028 6.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0635 7.6956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5636 7.7079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3028 6.3781 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0634 7.6710 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.7706 8.4316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3562 6.9104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8240 8.9638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3240 8.9515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0846 10.2444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3453 11.5495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8453 11.5618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0847 10.2690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1059 12.8424 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5171 0.3043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6085 -1.0343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5171 -0.3043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7492 0.0151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0877 -0.0763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 1.5665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0763 3.0877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5665 2.6620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8365 1.5363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6127 1.5293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9818 3.8564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9511 6.2278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 3.9007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9395 8.1644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2818 8.9248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3650 8.9159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6946 8.1336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6666 4.7148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3243 3.9545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9114 4.7456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2411 3.9633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9337 4.0756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6337 4.0535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6720 8.7299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9721 8.7520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8942 5.3340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9154 7.9074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2846 10.2345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2539 12.6059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8847 10.2788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 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 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 47 1 0 0 0 0 10 48 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 49 1 0 0 0 0 14 50 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 58 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 59 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 61 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 62 1 0 0 0 0 31 32 1 0 0 0 0 31 63 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 64 1 0 0 0 0 34 65 1 0 0 0 0 M END