B57GXV
  -OEChem-04012114453D

 46 49  0     1  0  0  0  0  0999 V2000
   -0.9310    0.3836    2.2179 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7306   -3.4529   -2.3487 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6045   -4.2021   -0.4978 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4660   -2.4580   -1.4832 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.2904    1.0405    2.6443 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9183   -0.0393    3.1935 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5467   -0.9233    1.2014 N   0  0  1  0  0  0  0  0  0  0  0  0
   -1.7062   -1.7209    0.7689 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3345   -0.6695    0.0214 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.0419   -1.8130   -0.9225 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8072   -0.6275    0.3401 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3975   -2.1872   -0.3994 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7133    0.1255   -0.4243 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2466   -1.3735    1.4341 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7394    1.4559    1.0689 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0845    0.1219   -0.0738 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3026   -3.0770   -1.1831 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2887    0.8821   -1.5286 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5950   -1.3771    1.7787 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5091   -0.6347    1.0306 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9907    0.8748   -0.8381 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1223    2.6413    0.6689 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9952    1.1186    0.5642 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2028    1.6244   -2.2768 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5512    1.6208   -1.9323 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7611    3.4892   -0.2357 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6340    1.9667   -0.3404 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0169    3.1519   -0.7405 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6999    4.0587   -1.7078 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0009    0.2663   -0.4289 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6172   -2.6836   -0.8413 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0905   -1.4881   -1.9652 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5686   -1.9783    2.0295 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2567    0.9138   -1.8620 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9375   -1.9612    2.6279 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5584   -0.6530    1.3176 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0494    0.8866   -0.5872 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1434    2.9264    1.0427 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5042    0.2115    0.8756 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8627    2.2023   -3.1313 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2625    2.1981   -2.5158 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2689    4.4084   -0.5421 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6133    1.6941   -0.7248 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4239    3.7911   -2.7325 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7888    3.9938   -1.6091 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4243    5.1040   -1.5316 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  2  0  0  0  0
  1  6  2  0  0  0  0
  1  7  1  0  0  0  0
  1 15  1  0  0  0  0
  2 17  1  0  0  0  0
  3 17  1  0  0  0  0
  4 17  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 12  2  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
  9 30  1  0  0  0  0
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 29 46  1  0  0  0  0
M  END

$$$$