File: test16.xyz

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rdkit 202503.1-5
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file content (14 lines) | stat: -rw-r--r-- 492 bytes parent folder | download | duplicates (15) 
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CC(NC)=O
C     -1.948353    0.027843   -0.036566
C     -0.536300   -0.431627   -0.200431
N      0.543979    0.425028    0.188067
C      1.936126    0.015359    0.052961
O     -0.303434   -1.582681   -0.659583
H     -2.069689    1.033171   -0.491307
H     -2.196103    0.083012    1.043824
H     -2.648698   -0.676632   -0.533707
H      0.331771    1.370541    0.579369
H      2.164920   -0.195237   -1.012973
H      2.604553    0.826917    0.410230
H      2.121227   -0.895693    0.660114