BR17WE
  -OEChem-04012112043D

 31 33  0     1  0  0  0  0  0999 V2000
    2.0842   -2.4755    0.0597 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.9046    0.4616    0.9760 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7503   -1.2358   -1.5956 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2364    2.0300    1.3185 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3006    0.1641    0.1433 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6206    1.7381   -0.7257 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9792   -1.4501    0.8351 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2304   -0.6738    0.3003 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6446    1.4247   -0.7726 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9256   -0.5143    0.5611 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.7030   -0.4899   -1.0145 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.5662   -1.3602   -0.5316 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.1300    0.1880    0.2747 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.8983    1.4786    0.0563 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5806   -0.2928    0.2859 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3776    1.3878   -0.4689 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3830    0.6968   -0.2592 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7563    0.4747   -0.2398 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3256   -1.5520    0.7969 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6742   -1.1196    1.4391 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3344    0.2420   -1.7422 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8916   -1.6938   -1.3246 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7247   -0.4841    0.9072 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2849    2.2148   -0.4735 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8183    1.2992   -0.5083 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4967    1.9778   -0.7081 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0284   -1.9138   -0.9563 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7251    2.8534    1.1494 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7402   -2.4601    1.2212 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2933    2.2821   -1.1771 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6382    1.2400   -0.7476 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 12  1  0  0  0  0
  2 10  1  0  0  0  0
  2 13  1  0  0  0  0
  3 11  1  0  0  0  0
  3 27  1  0  0  0  0
  4 14  1  0  0  0  0
  4 28  1  0  0  0  0
  5 10  1  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
  6 16  2  0  0  0  0
  6 17  1  0  0  0  0
  7 15  2  0  0  0  0
  7 19  1  0  0  0  0
  8 18  1  0  0  0  0
  8 19  2  0  0  0  0
  9 18  1  0  0  0  0
  9 30  1  0  0  0  0
  9 31  1  0  0  0  0
 10 12  1  0  0  0  0
 10 20  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 11 21  1  0  0  0  0
 12 22  1  0  0  0  0
 13 14  1  0  0  0  0
 13 23  1  0  0  0  0
 14 24  1  0  0  0  0
 14 25  1  0  0  0  0
 15 17  1  0  0  0  0
 16 26  1  0  0  0  0
 17 18  2  0  0  0  0
 19 29  1  0  0  0  0
M  END

$$$$