B21ARL
  -OEChem-04022109103D

 25 27  0     0  0  0  0  0  0999 V2000
    0.3610    2.5979   -0.0014 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2006    2.5383    0.0015 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2432   -2.8031   -0.0001 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8961    0.5471   -0.0008 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9154   -0.8472   -0.0009 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5405    0.5233   -0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5209   -0.8910   -0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3260    1.2299   -0.0008 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2874   -1.5635   -0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1579    1.3141    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1981   -1.5790   -0.0007 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7754    1.1926   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7370   -1.5942    0.0007 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4233    0.5517    0.0011 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4417   -0.7817    0.0009 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9736    0.4780    0.0007 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9544   -0.9132    0.0013 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2744   -2.6520   -0.0004 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8506    2.2765    0.0174 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7463   -2.6822    0.0013 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3490    1.1169    0.0022 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3819   -1.3223    0.0016 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9218    1.0078    0.0051 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8871   -1.4696    0.0031 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0707    2.9030   -0.5899 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0
  1 25  1  0  0  0  0
  2 10  2  0  0  0  0
  3 11  2  0  0  0  0
  4  5  1  0  0  0  0
  4  8  2  0  0  0  0
  4 10  1  0  0  0  0
  5  9  2  0  0  0  0
  5 11  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6 12  2  0  0  0  0
  7  9  1  0  0  0  0
  7 13  2  0  0  0  0
  9 18  1  0  0  0  0
 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
 12 19  1  0  0  0  0
 13 17  1  0  0  0  0
 13 20  1  0  0  0  0
 14 15  2  0  0  0  0
 14 21  1  0  0  0  0
 15 22  1  0  0  0  0
 16 17  2  0  0  0  0
 16 23  1  0  0  0  0
 17 24  1  0  0  0  0
M  END

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