B5NI9P
  -OEChem-04012115152D

 47 46  0     1  0  0  0  0  0999 V2000
    7.3199    3.0409    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.9538    3.4069    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    6.3199    4.7729    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.2181    3.1200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5519    3.9069    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6859    5.4069    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3521    4.6200    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6200    3.6200    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8521    6.1588    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.8520    6.1588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1611    5.2078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5430    5.2078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4398    6.9679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3521    3.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4860    3.1200    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4860    2.1200    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.0331    7.8814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6200    1.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3521    1.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.8199    3.9069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6859    4.4069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5706    6.7113    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9169    6.7754    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2456    6.2878    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4711    4.6708    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7275    5.4600    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9766    5.4600    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2330    4.6708    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8705    6.5219    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9538    7.3146    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4860    3.7400    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0230    2.4300    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5995    8.1336    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7809    8.4478    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4667    7.6292    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4079    2.2026    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0094    1.5123    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0420    1.0831    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8890    1.3100    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6620    2.1569    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0831    3.3100    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6200    4.2400    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.6200    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6200    0.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2400    0.6200    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0889    4.2169    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 21  1  0  0  0  0
  2 21  1  0  0  0  0
  3 21  1  0  0  0  0
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  5 22  1  0  0  0  0
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  7 11  1  0  0  0  0
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 15  8  1  6  0  0  0
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  9 23  1  0  0  0  0
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 20 46  1  0  0  0  0
 21 22  1  0  0  0  0
M  END

$$$$