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HEADER
COMPND    NSF (exp)
AUTHOR Gérard Dupuis

créé à partir des valeurs expérimentales.

ATOM      1  N                   0.000   0.000   0.000                          
ATOM      2  S                   1.450   0.000   0.000                          
ATOM      3  F                   2.182   1.467   0.000                          


CONECT    1    2    2     2
CONECT    2    3    

MASTER        0    0    0    0    0    0    0    0    5    0    0    0
END