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ALATIS outputs for bmse001134.mol
Standard InChI (download):
InChI=1S/C3H6N2O2/c4-2-5-1-3(6)7/h2H,1H2,(H2,4,5)(H,6,7)
output in pdb format (download):
output in xyz format (download):
The InChI-1 program has generated the following warning: "Warning (Proton(s) added/removed) structure #1."
Check the structure file for possible problems. This type of warnings could become problematic if you are interested in running ANTECHAMBER.
uploaded structure file (aux. option applied)(download) | structure file with unique atom labels(download) |
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Correspondence map between input and unique labels (download) |
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