BS7I5D -OEChem-04022105253D 64 69 0 1 0 0 0 0 0999 V2000 2.7251 -0.0223 -1.1503 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.3321 -0.9152 -1.7183 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0284 1.1549 -0.6672 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3876 -0.6024 -2.4363 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6821 -1.2337 0.0451 N 0 0 1 0 0 0 0 0 0 0 0 0 -1.4739 -1.1364 1.2839 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0923 -0.6921 0.2319 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8688 -1.4700 -1.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5103 0.1848 -2.4293 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3446 -1.6393 0.5831 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5660 -3.0686 1.0743 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9087 -0.7051 1.6969 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -3.6242 0.0345 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4842 -2.4710 -0.1984 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4243 -1.1411 2.3025 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9535 0.2284 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5894 -1.9985 1.6886 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0148 0.2582 -0.0582 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6733 -2.0471 0.6097 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 0.3477 -1.1676 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3363 -0.5384 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 1.0010 -0.1228 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1862 -0.0331 -2.2811 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0805 0.6683 -0.1893 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5006 1.2465 -0.2412 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4458 1.4184 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2784 0.5994 -0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1336 0.8171 -1.4094 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1853 1.9008 0.7962 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8136 1.8325 0.5646 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1362 2.0678 2.0629 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5029 2.3085 1.9423 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2166 1.6431 -0.8955 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7418 2.8785 0.5799 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9270 2.7829 -0.1414 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6278 -1.6463 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6387 -3.6468 1.1264 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0425 -3.0866 2.0623 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6663 -0.6989 2.4922 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8528 0.3300 1.3508 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0278 -4.5336 0.3661 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -3.8533 -0.8899 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3051 -2.4927 0.5265 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9058 -2.5242 -1.2051 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3021 -2.1434 2.7312 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6823 -0.4889 3.1472 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1366 0.8837 0.7242 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3757 0.6597 1.9619 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0266 -1.6449 2.6323 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2345 -3.0227 1.8567 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3607 1.2856 -0.1935 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5502 -0.0291 -1.0115 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2938 -2.5721 -0.2765 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5240 -2.6207 0.9984 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7388 -0.5453 -3.1263 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3935 1.2395 1.2189 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1975 0.9747 -1.5643 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2524 2.0961 0.7185 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9174 1.9293 1.1704 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6084 2.3797 2.9597 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0381 2.8123 2.7418 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1433 1.5732 -1.4563 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5377 3.7692 1.1678 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6391 3.6036 -0.1176 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 5 1 0 0 0 0 1 20 1 0 0 0 0 2 8 1 0 0 0 0 2 27 1 0 0 0 0 5 10 1 0 0 0 0 5 14 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 7 21 1 0 0 0 0 8 21 2 0 0 0 0 9 23 1 0 0 0 0 9 28 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 36 1 0 0 0 0 11 13 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 15 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 18 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 19 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 22 1 0 0 0 0 20 23 2 0 0 0 0 21 24 1 0 0 0 0 22 25 1 0 0 0 0 22 26 2 0 0 0 0 23 55 1 0 0 0 0 24 27 1 0 0 0 0 24 30 2 0 0 0 0 25 28 1 0 0 0 0 25 29 2 0 0 0 0 26 31 1 0 0 0 0 26 56 1 0 0 0 0 27 33 2 0 0 0 0 28 57 1 0 0 0 0 29 32 1 0 0 0 0 29 58 1 0 0 0 0 30 34 1 0 0 0 0 30 59 1 0 0 0 0 31 32 2 0 0 0 0 31 60 1 0 0 0 0 32 61 1 0 0 0 0 33 35 1 0 0 0 0 33 62 1 0 0 0 0 34 35 2 0 0 0 0 34 63 1 0 0 0 0 35 64 1 0 0 0 0 M END $$$$