B1CJA2
  -OEChem-04042103553D

 51 53  0     0  0  0  0  0  0999 V2000
    2.2574   -1.7560    0.3111 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5576   -1.0956   -0.4795 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4366   -2.1833    1.6916 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7964   -2.5670   -0.7729 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1153    0.1616   -0.1123 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7291    0.8292   -1.3423 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1500   -0.0398    0.9938 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4266    2.1368   -0.9818 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8475    1.2678    1.3546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4589    1.9362    0.1253 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2087   -1.2478   -0.2964 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5384   -1.5581    0.0765 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0345   -0.1731    0.1299 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3846   -1.5302   -1.3858 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6593   -1.1209    0.9795 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0109   -1.6852   -1.1993 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4745    0.2484   -1.1247 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2022    0.6527    1.2416 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0822    1.4958   -1.2678 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8101    1.8999    1.0984 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2501    2.3215   -0.1562 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3105   -0.6074   -2.3385 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7417    0.2353    2.6003 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8997    3.6550   -0.3108 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3369    0.8395    0.2679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4429    0.1432   -1.8166 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9507    1.0132   -2.0927 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6746   -0.4663    1.8844 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8926   -0.7814    0.6715 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6799    2.8711   -0.6554 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9151    2.5517   -1.8706 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1256    1.9502    1.8198 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6301    1.0759    2.0972 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8893    2.9037    0.4076 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2824    1.3181   -0.2530 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8090   -1.6398   -2.3800 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2888   -0.9205    1.8415 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5885   -1.9499   -2.0615 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0947   -1.2143    2.1781 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4307    1.8296   -2.2424 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9468    2.5475    1.9613 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0140   -1.4446   -2.3455 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2832   -0.9128   -2.5108 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5638   -0.0276   -3.2368 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3722   -0.5543    3.0180 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8442    1.0734    3.3029 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6835   -0.0066    2.6319 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9838    3.5604   -0.1938 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6886    4.0852   -1.2957 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5276    4.3659    0.4348 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
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  2  5  1  0  0  0  0
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  8 10  1  0  0  0  0
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  9 33  1  0  0  0  0
  9 34  1  0  0  0  0
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 25 51  1  0  0  0  0
M  END

$$$$