B6KD8I
  -OEChem-04022106253D

 21 21  0     1  0  0  0  0  0999 V2000
   -2.5088   -0.1326    0.2257 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4808    0.7249   -0.7676 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2619    0.6477    1.4331 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9952   -1.5063    0.2910 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8844   -0.3096   -0.2442 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6748    1.3454    0.7246 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6211   -1.8484    0.1536 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2153    0.1337    0.0418 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.0126   -0.1055   -0.7871 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.3620    1.2467   -0.7827 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5109   -0.4917   -0.3837 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.7150    0.2958    0.0956 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1400    0.2164    1.1192 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9638   -0.7069   -1.6832 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8266    2.0752   -0.2625 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1622    1.5503   -1.6822 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5694   -0.5315   -1.4789 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4781   -2.2820   -0.1887 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8574   -2.4192   -0.2079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3820    0.9135   -0.4150 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6628    0.1970    0.0713 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  1  9  1  0  0  0  0
  2 20  1  0  0  0  0
  5 12  1  0  0  0  0
  5 21  1  0  0  0  0
  6 12  2  0  0  0  0
  7 11  1  0  0  0  0
  7 18  1  0  0  0  0
  7 19  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  1  0  0  0  0
  8 13  1  0  0  0  0
  9 10  1  0  0  0  0
  9 14  1  0  0  0  0
 10 15  1  0  0  0  0
 10 16  1  0  0  0  0
 11 12  1  0  0  0  0
 11 17  1  0  0  0  0
M  END

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