%chk=000050460.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050460

1 1
 N    2.732100     -0.2126000      0.1927000    
 C    1.273000     -0.6389000      0.2673000    
 C   0.3553000      0.5582000     -1.6600000E-02
 C    2.976900      0.9312000       1.166600    
 C    3.623700      -1.390300      0.5591000    
 C    3.054900      0.2474000      -1.221600    
 C   -1.122500      0.2059000      2.9100001E-02
 C   0.7192000       1.177900      -1.370900    
 C   -2.021600       1.149500      0.4855000    
 C   -1.524700      -1.048100     -0.3866000    
 C   -3.377800      0.8259000      0.5277000    
 C   -2.880900      -1.371600     -0.3447000    
 C   -3.807600     -0.4345000      0.1124000    
 H    1.164400      -1.454400     -0.4554000    
 H    1.093900      -1.040900       1.272500    
 H   0.4963000       1.314100      0.7649000    
 H    2.588900      0.6443000       2.148600    
 H    4.058400       1.092000       1.229300    
 H    2.512600       1.852800      0.8095000    
 H    3.450900      -2.192500     -0.1645000    
 H    4.668600      -1.066500      0.5309000    
 H    3.360300      -1.721400       1.568100    
 H    2.550100     -0.3681000      -1.967900    
 H    3.089000       1.329500      -1.328100    
 H    4.115600     -4.8000002E-03  -1.372500    
 H    1.423400       2.005700      -1.309900    
 H   0.8446000      0.4720000      -2.193900    
 H  -0.1683000       1.735700      -1.716700    
 H   -1.698100       2.134600      0.8080000    
 H  -0.8435000      -1.796400     -0.7730000    
 H   -4.099500       1.555900      0.8826000    
 H   -3.216700      -2.350800     -0.6736000    
 H   -4.863700     -0.6857000      0.1436000    


%chk=000050460-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000050460

1 1
N 2.776325 -0.177539 0.230175
C 1.223963 -0.387898 0.142646
C 0.321650 0.815034 -0.248489
C 3.118201 1.150448 0.897351
C 3.345606 -1.316679 1.080089
C 3.423650 -0.247356 -1.152843
C -1.117544 0.290785 -0.080119
C 0.552060 1.418645 -1.657035
C -1.908266 0.724511 1.013333
C -1.666003 -0.644317 -0.996657
C -3.225354 0.241275 1.185325
C -2.981413 -1.128550 -0.825343
C -3.764203 -0.688586 0.267234
H 1.083348 -1.225501 -0.563308
H 0.924205 -0.732506 1.148214
H 0.460596 1.615854 0.503477
H 2.598764 1.212539 1.865591
H 4.207014 1.196752 1.055830
H 2.802897 1.979739 0.249199
H 3.010047 -2.277829 0.661572
H 4.445477 -1.265632 1.064545
H 2.981168 -1.214731 2.113434
H 3.248915 -1.248304 -1.575980
H 2.980964 0.514472 -1.805738
H 4.505829 -0.071583 -1.048594
H 1.490499 2.000071 -1.728002
H 0.558880 0.646204 -2.447272
H -0.270131 2.115761 -1.889553
H -1.503570 1.455882 1.724610
H -1.083774 -0.984924 -1.862740
H -3.829782 0.593169 2.027825
H -3.397495 -1.842713 -1.543693
H -4.785323 -1.061395 0.397415


