B2HET7
  -OEChem-04012114183D

 22 22  0     0  0  0  0  0  0999 V2000
   -4.6127   -0.3494   -0.9750 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1363    2.2059    0.1349 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8988   -0.3401   -0.6437 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0274   -0.0978    0.4969 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0087    0.9362   -0.2530 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3692   -0.0530    0.9135 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3321   -0.2268   -0.2537 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7939   -0.1613    0.1717 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6705    1.0947    0.1308 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6831   -1.3114    0.4727 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9589   -1.4467    0.1047 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7241   -0.2502   -0.2997 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5602    0.9120    1.3986 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5423   -0.8245    1.6742 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1438    0.5391   -1.0172 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1456   -1.1841   -0.7575 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0240   -0.9477    0.8973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0281    0.8126    0.6128 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1037   -2.1792    0.7695 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5055    1.7800   -0.5248 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4529   -2.4105    0.0917 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5368   -0.3031   -0.6758 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0
  1 22  1  0  0  0  0
  2  9  2  0  0  0  0
  3 12  2  0  0  0  0
  4  6  1  0  0  0  0
  4  9  1  0  0  0  0
  4 10  1  0  0  0  0
  5  9  1  0  0  0  0
  5 12  1  0  0  0  0
  5 20  1  0  0  0  0
  6  7  1  0  0  0  0
  6 13  1  0  0  0  0
  6 14  1  0  0  0  0
  7  8  1  0  0  0  0
  7 15  1  0  0  0  0
  7 16  1  0  0  0  0
  8 17  1  0  0  0  0
  8 18  1  0  0  0  0
 10 11  2  0  0  0  0
 10 19  1  0  0  0  0
 11 12  1  0  0  0  0
 11 21  1  0  0  0  0
M  END

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