-ISIS-  10049414582D

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    1.4053   -0.0860    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4053   -1.1917    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.9967   -3.2651    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1076   -3.2651    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.4409   -2.3030    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.4788   -0.6388    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.5166   -1.1917    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.4409   -1.1917    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.5522   -1.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9967   -0.2371    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5166   -2.3030    0.0000 N   0  0  3  0  0  0  0  0  0  0  0  0
    2.5166   -0.0860    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4053   -2.3030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 17  1  2  0  0  0  0
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 11 16  1  6  0  0  0
M  END