DR0119 -OEChem-05042003173D 45 47 0 1 0 0 0 0 0999 V2000 3.2079 -2.2900 -1.0898 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2871 0.9936 -0.6544 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6602 -1.1021 -0.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1289 2.9776 -0.1203 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8134 0.4075 1.2141 N 0 0 2 0 0 0 0 0 0 0 0 0 3.1565 -0.8816 0.9212 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0280 0.9721 -0.1324 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9748 -1.4516 -0.2464 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4952 -0.2150 -0.9882 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6945 -0.5440 0.5605 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6587 1.5061 -0.5953 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5844 0.4093 -0.6381 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0541 0.2611 1.9703 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7639 0.1169 -0.7253 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0809 0.8877 -0.7402 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2124 0.0460 -0.1717 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9238 2.2270 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9477 -0.7507 -1.0265 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4725 0.1030 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9860 -1.5225 -0.5051 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5108 -0.6688 1.7045 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2675 -1.4815 0.8604 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1554 -1.5594 1.7829 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7516 1.7951 -0.1388 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8262 -2.0359 0.1227 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1468 -0.1574 -2.0247 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5914 -0.2458 -1.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1832 -1.4939 0.3829 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1989 -0.0984 1.4347 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3318 2.3153 0.0719 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7455 1.9630 -1.5891 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -0.1522 -1.5726 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8119 -0.3500 1.4697 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8476 -0.1878 2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4915 1.2468 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8807 -3.0277 -0.5473 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3115 1.1111 -1.7909 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1562 2.8411 -0.4899 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6307 2.1455 1.0455 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7341 -0.7906 -2.0905 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8911 0.6969 1.8782 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7736 2.6154 0.5093 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5747 -2.1562 -1.1621 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7261 -0.6427 2.7688 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0749 -2.0838 1.2667 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 36 1 0 0 0 0 2 12 1 0 0 0 0 2 14 1 0 0 0 0 3 14 2 0 0 0 0 4 17 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 6 23 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 12 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 37 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 20 1 0 0 0 0 18 40 1 0 0 0 0 19 21 2 0 0 0 0 19 41 1 0 0 0 0 20 22 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 M END $$$$