B2VLT7 -OEChem-04042104003D 49 52 0 0 0 0 0 0 0999 V2000 -6.5304 0.1259 -0.5877 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5466 -2.5567 -0.1921 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6677 -3.8116 0.0209 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4881 -1.0950 -1.1782 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4900 1.7685 -0.1536 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7295 1.0193 1.8531 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0546 -0.7642 0.5392 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5265 -0.1937 0.3948 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6136 1.0567 0.1593 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0946 -0.3198 0.7471 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2196 -0.1063 -0.2976 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2075 -1.3203 -0.0661 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2485 1.0125 0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6267 2.0516 0.1444 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4874 -1.5221 0.6531 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5616 -1.3227 -0.4287 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7674 1.4361 -0.3166 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9432 -1.7975 1.0405 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -2.7203 0.1464 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3852 0.9386 1.1844 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4874 3.4655 0.5433 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1389 1.9068 -0.5607 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8474 -1.1841 -0.0067 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1371 -0.1487 -0.1347 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2855 0.2097 0.5715 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0554 0.0987 -1.5051 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3521 0.8156 -0.0927 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1222 0.7043 -2.1692 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2704 1.0630 -1.4631 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5493 1.1903 0.6428 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 1.9243 0.8683 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0652 -2.2131 -0.7853 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1439 -1.3738 2.0318 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1841 -2.8626 1.1141 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8591 1.3570 2.0793 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4048 1.6890 0.3863 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6644 0.7836 1.4431 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9880 4.0359 -0.2465 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8938 3.5563 1.4589 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4597 3.9307 0.7346 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1321 2.8290 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7266 1.1638 -1.1091 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6475 2.1085 0.3871 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1989 -0.9129 1.5355 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3425 0.0140 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 -0.1490 -2.1201 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0593 0.8972 -3.2364 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0767 1.5323 -2.0197 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2932 2.0171 0.3519 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 17 1 0 0 0 0 2 12 1 0 0 0 0 2 19 1 0 0 0 0 3 19 2 0 0 0 0 4 23 2 0 0 0 0 5 30 1 0 0 0 0 5 49 1 0 0 0 0 6 30 2 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 7 44 1 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 9 11 1 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 15 2 0 0 0 0 10 20 1 0 0 0 0 11 16 2 0 0 0 0 12 16 1 0 0 0 0 13 31 1 0 0 0 0 14 17 2 0 0 0 0 14 21 1 0 0 0 0 15 18 1 0 0 0 0 15 19 1 0 0 0 0 16 32 1 0 0 0 0 17 22 1 0 0 0 0 18 23 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 25 27 2 0 0 0 0 25 45 1 0 0 0 0 26 28 1 0 0 0 0 26 46 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 M END $$$$