BRKH45 -OEChem-04042106093D 43 46 0 1 0 0 0 0 0999 V2000 2.8345 2.2294 -0.4642 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9988 0.9256 -0.2078 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3245 0.5930 -0.6527 N 0 0 3 0 0 0 0 0 0 0 0 0 -3.8739 -1.6825 0.0615 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9398 -2.9788 -0.5594 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4704 0.6659 2.0085 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6876 0.8035 -0.4550 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3153 0.3485 -1.8741 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4014 0.4631 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8418 0.7325 -2.0079 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 0.2087 0.1302 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0167 0.6024 -0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7744 -0.5814 -0.3003 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0060 -0.1565 -0.7097 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0665 0.0266 1.5084 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6184 1.8218 -0.0383 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1399 -0.5565 0.0271 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9697 1.8593 0.2873 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1707 -0.7038 -0.1714 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2310 -0.5206 2.0469 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7162 0.6777 0.3176 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2342 -1.8324 -0.5844 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2832 -0.8858 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1298 0.7724 0.6652 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2342 -2.8323 -0.2337 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4182 -0.7394 -1.9766 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9076 0.8328 -2.6575 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4104 -0.5670 0.7074 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2396 1.1533 1.1682 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7357 1.7700 -2.3443 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 0.0764 -2.7189 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1091 2.5146 0.4241 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9515 -0.0151 -1.7849 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2710 0.3158 2.1887 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0477 2.7466 -0.0587 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4353 2.8146 0.5165 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9912 -0.9855 -0.8248 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3205 -0.6589 3.1204 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1907 -1.9697 -0.8506 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1905 -1.3104 1.6264 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8312 -3.7357 -0.2044 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7720 0.5329 2.7331 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4386 0.7182 2.3071 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 32 1 0 0 0 0 2 24 2 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 3 12 1 0 0 0 0 4 17 1 0 0 0 0 4 25 2 0 0 0 0 5 22 2 0 0 0 0 5 25 1 0 0 0 0 6 24 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 13 22 1 0 0 0 0 14 19 1 0 0 0 0 14 33 1 0 0 0 0 15 20 2 0 0 0 0 15 34 1 0 0 0 0 16 18 2 0 0 0 0 16 35 1 0 0 0 0 17 21 2 0 0 0 0 18 21 1 0 0 0 0 18 36 1 0 0 0 0 19 23 2 0 0 0 0 19 37 1 0 0 0 0 20 23 1 0 0 0 0 20 38 1 0 0 0 0 21 24 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 25 41 1 0 0 0 0 M END $$$$