BRH36X
  -OEChem-04042102503D

 56 59  0     1  0  0  0  0  0999 V2000
    2.7756   -5.0035   -1.3501 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0822    2.2809   -1.5123 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9020    0.5216   -0.3629 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4428    2.8693    0.4559 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6252    3.8097   -1.4452 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6630    0.5007    0.9031 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5314    0.9139    0.3927 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5643   -0.7583    1.6426 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.9477   -0.9318    1.8100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4453    0.1230    0.8601 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1491   -1.8824    0.8506 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8317    1.1345    0.5729 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8600    0.2291    0.5407 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6693   -2.1570   -0.4299 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1755   -2.6567    1.3917 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9017    1.9104   -0.5842 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9518    1.0044    1.3940 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3040    1.2137   -0.3421 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7733   -0.6535    1.1174 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2158   -3.2058   -1.1696 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7217   -3.7057    0.6522 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2420   -3.9803   -0.6284 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6610    1.3155   -0.6483 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0916    2.5563   -0.9201 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1417    1.6501    1.0580 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1304   -0.5515    0.8115 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2116    2.4261   -0.0990 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5742    0.4330   -0.0715 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4519    3.0999   -0.4487 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2380   -5.2288   -2.6524 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0846    3.1422   -2.0578 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7683   -0.4188    0.2693 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0214   -0.6841    2.6364 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2566   -0.6561    2.8248 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3109   -1.9353    1.5737 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1270   -1.5740   -0.8824 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5599   -2.4547    2.3879 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0496    2.0246   -1.2493 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9296    0.4208    2.3095 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5593    1.8772   -0.7671 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4721   -1.4285    1.8152 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7968   -3.3639   -2.1574 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5212   -4.3053    1.0789 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1263    3.1548   -1.8267 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9886    1.5244    1.7268 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7821   -1.2692    1.2977 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7779   -6.0788   -3.0824 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4116   -4.3726   -3.3130 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1807   -5.5113   -2.6079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5966    3.8468   -2.7216 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3674    2.5903   -2.6750 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5961    3.7388   -1.2798 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7848   -0.2030   -0.0759 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7701   -0.2976    1.3579 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5407   -1.4459   -0.0358 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    3.3281    0.2109 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 22  1  0  0  0  0
  1 30  1  0  0  0  0
  2 23  1  0  0  0  0
  2 31  1  0  0  0  0
  3 28  1  0  0  0  0
  3 32  1  0  0  0  0
  4 29  1  0  0  0  0
  4 56  1  0  0  0  0
  5 29  2  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6 12  1  0  0  0  0
  7 10  2  0  0  0  0
  8  9  1  0  0  0  0
  8 11  1  0  0  0  0
  8 33  1  0  0  0  0
  9 10  1  0  0  0  0
  9 34  1  0  0  0  0
  9 35  1  0  0  0  0
 10 13  1  0  0  0  0
 11 14  2  0  0  0  0
 11 15  1  0  0  0  0
 12 16  2  0  0  0  0
 12 17  1  0  0  0  0
 13 18  2  0  0  0  0
 13 19  1  0  0  0  0
 14 20  1  0  0  0  0
 14 36  1  0  0  0  0
 15 21  2  0  0  0  0
 15 37  1  0  0  0  0
 16 24  1  0  0  0  0
 16 38  1  0  0  0  0
 17 25  2  0  0  0  0
 17 39  1  0  0  0  0
 18 23  1  0  0  0  0
 18 40  1  0  0  0  0
 19 26  2  0  0  0  0
 19 41  1  0  0  0  0
 20 22  2  0  0  0  0
 20 42  1  0  0  0  0
 21 22  1  0  0  0  0
 21 43  1  0  0  0  0
 23 28  2  0  0  0  0
 24 27  2  0  0  0  0
 24 44  1  0  0  0  0
 25 27  1  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
 30 47  1  0  0  0  0
 30 48  1  0  0  0  0
 30 49  1  0  0  0  0
 31 50  1  0  0  0  0
 31 51  1  0  0  0  0
 31 52  1  0  0  0  0
 32 53  1  0  0  0  0
 32 54  1  0  0  0  0
 32 55  1  0  0  0  0
M  END

$$$$