BS84QV
  -OEChem-04042102233D

 18 19  0     0  0  0  0  0  0999 V2000
    4.6630    0.0216   -0.0070 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -2.1542   -1.0786    0.3792 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4097   -0.6298    0.2211 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5909    0.6251   -0.2210 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0166    0.0002    0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4526   -0.0061    0.0019 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6757    1.1905    0.2225 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6859   -1.1839   -0.2239 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0705    1.1969    0.2200 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0808   -1.1776   -0.2263 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3253    1.0287   -0.3627 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7732    0.0129   -0.0044 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1552    2.1268    0.4081 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1733   -2.1251   -0.4073 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5951    2.1325    0.3963 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6133   -2.1083   -0.4043 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1233    2.0286   -0.7185 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2031   -1.2252    0.4303 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 12  1  0  0  0  0
  2  3  1  0  0  0  0
  2  6  2  0  0  0  0
  3  4  1  0  0  0  0
  3 18  1  0  0  0  0
  4 11  2  0  0  0  0
  5  6  1  0  0  0  0
  5  7  2  0  0  0  0
  5  8  1  0  0  0  0
  6 11  1  0  0  0  0
  7  9  1  0  0  0  0
  7 13  1  0  0  0  0
  8 10  2  0  0  0  0
  8 14  1  0  0  0  0
  9 12  2  0  0  0  0
  9 15  1  0  0  0  0
 10 12  1  0  0  0  0
 10 16  1  0  0  0  0
 11 17  1  0  0  0  0
M  END

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