D0M8KV OpenBabel06211915323D 60 63 0 0 0 0 0 0 0 0999 V2000 0.9304 -0.0678 0.0235 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5309 1.1109 -0.3844 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2510 -0.0678 0.0235 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5309 -1.2465 0.4313 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0907 -1.2465 0.4313 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3706 -0.0678 0.0235 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2909 -2.4905 0.8618 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0517 -2.4905 0.8618 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6115 -2.4905 0.8618 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8914 -1.3118 0.4539 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4512 -1.3118 0.4539 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7311 -2.4905 0.8618 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4911 -3.7345 1.2922 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6912 -0.0678 0.0235 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6139 0.9522 -0.3295 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1406 2.2173 -0.7673 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6207 0.9342 -0.3232 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0366 0.6855 -0.2372 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9725 1.7199 -0.5952 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4924 3.0031 -1.0392 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0765 3.2518 -1.1252 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4232 4.9981 -1.7295 Br 0 0 0 0 0 0 0 0 0 0 0 0 11.4669 1.4574 -0.5043 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6954 0.0851 -0.0295 N 0 0 0 0 0 0 0 0 0 0 0 0 13.9263 4.6374 1.0218 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1625 3.2184 1.5129 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5334 2.2344 0.5401 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7697 0.8154 1.0311 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1406 -0.1687 0.0584 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3769 -1.5877 0.5494 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2724 -2.4311 0.8412 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5629 -2.0192 0.6987 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0873 -0.2297 0.0795 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8914 2.0247 -0.7006 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2830 -0.0678 0.0235 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5747 -2.0911 0.7236 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8866 0.7768 -0.2688 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0837 -2.4905 0.8618 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0955 -3.3351 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4074 -0.4672 0.1617 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5430 -3.5497 1.2283 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2326 -4.5504 0.6501 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2326 -3.9790 2.3013 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 0.2714 0.8306 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 -0.2999 -0.8207 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 0.1929 -0.0667 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3806 -0.2340 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1631 3.7444 -1.2957 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9097 2.1502 0.1804 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9097 1.5788 -1.4708 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4485 5.3765 1.6305 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4407 5.4370 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7197 3.0971 2.4793 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2145 3.0337 1.5768 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9763 2.3557 -0.4264 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4815 2.4191 0.4762 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3269 0.6940 1.9976 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8217 0.6306 1.0951 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5835 -0.0473 -0.9081 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3980 -2.1130 0.7312 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 1 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 7 1 0 0 0 0 12 13 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 21 16 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 24 1 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 31 60 1 0 0 0 0 M END $$$$