%chk=000022262.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022262

0 1
 N   -2.857400      0.4721000     -0.5667000    
 C   -1.705100     -7.6700002E-02  0.1402000    
 C  -0.4405000      0.7135000     -0.2156000    
 C   -3.066100       1.873700     -0.2005000    
 C   -4.058900     -0.3128000     -0.2792000    
 C   0.8238000      0.1640000      0.4959000    
 C    1.084700      -1.310100      0.2004000    
 C    2.072700       1.003500      0.2586000    
 C   -3.315100       1.997000       1.300100    
 C   -4.237200       2.438000     -0.9985000    
 C   -4.356200     -0.2962000       1.217500    
 C   -3.866200      -1.739500     -0.7838000    
 C   0.5265000      -2.261100       1.026800    
 C    3.042900       1.044900       1.238100    
 C    1.870400      -1.640400     -0.8825000    
 C    2.193700       1.695900     -0.9280000    
 C   0.7655000      -3.608700      0.7570000    
 C    4.186200       1.814000       1.021100    
 C    2.109200      -2.987800      -1.152400    
 C    3.337100       2.464900      -1.145100    
 C    1.556800      -3.971900     -0.3326000    
 C    4.333300       2.523800     -0.1706000    
 H   -1.764100     -0.1595000       1.225100    
 H   -1.534900      -1.088800     -0.2344000    
 H  -0.5149000       1.762900      8.4500000E-02
 H  -0.3242000      0.6770000      -1.305900    
 H   -2.215000       2.491800     -0.4983000    
 H   -4.928300      5.6600001E-02 -0.8323000    
 H   0.6156000      0.2519000       1.574100    
 H   -2.949500       3.010800       1.542600    
 H   -4.358300       2.109700       1.601700    
 H   -2.710500       1.414200       1.994200    
 H   -4.151800       2.200000      -2.065000    
 H   -4.238900       3.532100     -0.9176000    
 H   -5.218200       2.109300     -0.6407000    
 H   -4.922700      -1.221900       1.418600    
 H   -3.547900     -0.4055000       1.938400    
 H   -5.112000      0.4361000       1.504700    
 H   -3.472000      -1.756800      -1.806300    
 H   -4.833500      -2.256400     -0.8096000    
 H   -3.214400      -2.342800     -0.1430000    
 H  -8.6099997E-02  -1.990300       1.881100    
 H    2.937500      0.4944000       2.168100    
 H    2.296500     -0.9097000      -1.559300    
 H    1.455000       1.666100      -1.719500    
 H   0.3360000      -4.374900       1.395800    
 H    4.962300       1.859300       1.779500    
 H    2.720300      -3.271600      -2.004300    
 H    3.454200       3.014600      -2.074500    
 H    1.741800      -5.021100     -0.5436000    
 H    5.224100       3.121600     -0.3402000    


%chk=000022262-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000022262

0 1
N -2.894162 0.667693 -0.134055
C -1.666257 0.188104 0.531361
C -0.378303 0.750158 -0.116964
C -3.317098 2.047001 0.237494
C -3.958919 -0.345900 -0.383338
C 0.915724 0.271494 0.603154
C 1.087963 -1.252197 0.471476
C 2.182706 1.014128 0.147398
C -4.183181 2.147386 1.529016
C -4.009597 2.766823 -0.943972
C -4.352754 -1.218392 0.847018
C -3.571171 -1.251699 -1.578272
C 0.835201 -2.108915 1.572100
C 3.338616 0.971890 0.971565
C 1.474937 -1.834310 -0.763830
C 2.260764 1.723970 -1.077381
C 0.960462 -3.512177 1.445747
C 4.533632 1.616997 0.589098
C 1.598130 -3.234399 -0.895906
C 3.457206 2.370669 -1.467138
C 1.340588 -4.080647 0.209081
C 4.598867 2.320444 -0.637306
H -1.654500 0.429797 1.624820
H -1.633261 -0.913781 0.463790
H -0.407033 1.857554 -0.102494
H -0.371904 0.440983 -1.179473
H -2.374543 2.595265 0.437779
H -4.859455 0.225165 -0.682401
H 0.781797 0.487821 1.684507
H -4.326397 3.206066 1.816920
H -5.184485 1.704529 1.373579
H -3.700155 1.627030 2.377016
H -3.368092 2.726110 -1.841233
H -4.206883 3.825713 -0.692092
H -4.980857 2.300395 -1.194143
H -5.214526 -1.864259 0.593010
H -3.522131 -1.881931 1.151636
H -4.632061 -0.596184 1.714189
H -3.391612 -0.639280 -2.478723
H -4.371235 -1.984534 -1.796480
H -2.646131 -1.819330 -1.362361
H 0.539039 -1.673827 2.535278
H 3.299135 0.420282 1.919563
H 1.697212 -1.184874 -1.619038
H 1.385332 1.784755 -1.732623
H 0.762754 -4.158035 2.309085
H 5.412005 1.572052 1.243270
H 1.900833 -3.666676 -1.856685
H 3.495225 2.914926 -2.418005
H 1.439693 -5.167287 0.107647
H 5.525083 2.822636 -0.938580


