B6EPR5 -OEChem-04022115583D 52 55 0 1 0 0 0 0 0999 V2000 -8.5666 0.4942 0.3893 F 0 0 0 0 0 0 0 0 0 0 0 0 -8.0853 -0.6801 -1.3762 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.8271 -1.5399 0.5980 F 0 0 0 0 0 0 0 0 0 0 0 0 4.4801 -0.8131 1.5356 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2295 -3.1967 1.3471 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3505 1.3999 0.4906 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6641 -0.1305 -0.3322 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1565 -2.6192 0.1516 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7823 0.8108 -0.2288 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4805 1.3317 0.2202 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2112 -0.6150 -0.5331 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9829 2.8191 1.4006 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4753 -0.9973 0.3105 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6542 -1.4880 -0.5804 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4091 -0.6658 -0.8616 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0052 -0.8841 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6281 -0.7882 0.3126 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7593 0.5152 0.3931 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8786 -0.0743 -1.7767 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8845 -2.4115 0.6789 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8429 0.7016 -0.6705 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0456 0.8844 -1.9589 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4496 0.5474 0.0977 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 2.2022 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 -0.2144 -0.6981 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5215 2.3595 0.5632 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1395 0.1300 -0.3471 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3252 1.8034 0.9563 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8271 1.3580 0.4076 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2600 0.1408 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6348 -0.3799 -0.1131 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7361 -0.3866 1.1851 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1159 -1.8686 -1.4933 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6077 0.4081 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9668 -0.9937 -1.8109 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5844 -1.4896 0.6527 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1924 -1.2433 -1.0605 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1005 -0.1432 1.1996 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1444 -1.0803 -2.1192 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9745 0.2578 -2.2944 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6786 -3.4799 0.2842 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4432 -0.2137 -0.7499 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5223 1.5371 -0.4748 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6797 1.9156 -2.0298 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6307 0.6680 -2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4826 2.8900 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4432 2.4468 -1.3175 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4898 -1.1935 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -0.2742 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9825 3.3373 0.3921 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3093 2.2427 1.6319 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3431 2.2013 0.8452 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 2 31 1 0 0 0 0 3 31 1 0 0 0 0 4 17 2 0 0 0 0 5 20 2 0 0 0 0 6 23 2 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 14 1 0 0 0 0 8 20 1 0 0 0 0 8 41 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 10 29 1 0 0 0 0 11 27 2 0 0 0 0 11 30 1 0 0 0 0 12 28 3 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 13 20 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 23 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 18 21 1 0 0 0 0 18 28 1 0 0 0 0 18 38 1 0 0 0 0 19 22 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 24 26 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 27 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 M END $$$$