%chk=000081261.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081261

0 1
 O    4.953800     -0.8137000      2.4000001E-03
 N    4.157400      0.3034000      1.9999999E-04
 C  -3.6800001E-02  8.0399998E-02 -8.9999998E-04
 C   -1.481600      2.9000000E-03 -9.9999997E-05
 C   0.5951000       1.323600      2.3700001E-02
 C   0.7240000      -1.088300     -2.5300000E-02
 C    2.748800      0.2294000     -7.9999998E-04
 C   -2.176500     -5.7500001E-02   1.207900    
 C   -2.179600     -9.7000003E-03  -1.207600    
 C    1.987800       1.398200      2.3800001E-02
 C    2.117000      -1.013800     -2.5300000E-02
 C   -3.569400     -0.1301000       1.208200    
 C   -3.572600     -8.2300000E-02  -1.207100    
 C   -4.267600     -0.1425000      6.9999998E-04
 H   1.6799999E-02   2.244400      4.3200001E-02
 H   0.2472000      -2.065500     -4.4500001E-02
 H   -1.647900     -4.8400000E-02   2.158200    
 H   -1.653700      3.7000000E-02  -2.158200    
 H    2.468800       2.372900      4.3200001E-02
 H    2.686500      -1.939100     -4.4900000E-02
 H   -4.110600     -0.1770000       2.148700    
 H   -4.116300     -9.1899998E-02  -2.147300    
 H   -5.352100     -0.1990000      1.1000000E-03
 H    4.622000       1.202300      2.5500000E-02
 H    5.427100     -0.7230000     -0.8420000    


%chk=000081261-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081261

0 1
O 4.999156 -0.782626 0.211908
N 4.248847 0.411986 -0.220616
C -0.017352 0.100486 -0.046441
C -1.516219 0.007950 -0.016661
C 0.636532 1.360807 -0.012400
C 0.787713 -1.066174 -0.101313
C 2.832571 0.275577 -0.100479
C -2.213051 -0.073483 1.217960
C -2.266445 -0.000083 -1.222317
C 2.042176 1.455124 -0.035096
C 2.196583 -0.989945 -0.129529
C -3.623975 -0.160716 1.247101
C -3.677447 -0.087380 -1.195095
C -4.361063 -0.167836 0.040232
H 0.036073 2.276171 0.036933
H 0.303732 -2.049385 -0.116597
H -1.643475 -0.068892 2.154395
H -1.738381 0.062271 -2.180758
H 2.524372 2.440496 -0.012103
H 2.805544 -1.897529 -0.146199
H -4.146013 -0.223403 2.208859
H -4.241003 -0.092479 -2.135218
H -5.454716 -0.235393 0.062152
H 4.640516 1.209015 0.301091
H 5.432926 -1.091858 -0.627007


