%chk=000089014.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089014

0 1
 N    3.242600       2.220000     -0.9720000    
 C    2.627800     -0.1058000       1.558200    
 C    3.412200     -0.1141000      0.2422000    
 C    1.111500     -9.6000005E-03   1.344900    
 C   0.6018000     -0.8594000      0.2087000    
 C    2.923000      -1.248600     -0.6715000    
 C  -0.8859000      -1.036300      0.1322000    
 C    1.430700      -1.424100     -0.6859000    
 C   -1.542500      8.1900001E-02 -0.6716000    
 C    3.317300       1.192900     -0.4377000    
 C   -3.015900     -0.1676000     -0.8328000    
 C   -4.018500      0.2909000     -5.9900001E-02
 C   -5.477100      2.9000000E-03 -0.2769000    
 C   -3.727100       1.176700       1.122000    
 H    2.956000      0.7188000       2.203400    
 H    2.847700      -1.033700       2.103400    
 H    4.471700     -0.2898000      0.4689000    
 H   0.8348000       1.034600       1.153900    
 H   0.6185000     -0.3017000       2.280100    
 H    3.361000      -2.196600     -0.3341000    
 H    3.273200      -1.087500      -1.698600    
 H   -1.116700      -2.005100     -0.3321000    
 H   -1.309600      -1.089200       1.143100    
 H    1.023900      -2.044500      -1.480400    
 H   -1.343800       1.061200     -0.2231000    
 H   -1.102400      0.1322000      -1.676500    
 H   -3.279300     -0.8110000      -1.671300    
 H   -6.031800      0.9349000     -0.4256000    
 H   -5.636600     -0.6260000      -1.158900    
 H   -5.896300     -0.5211000      0.5879000    
 H   -2.675600       1.210700       1.414800    
 H   -4.275600      0.8165000       1.999800    
 H   -4.056500       2.199800      0.9129000    


%chk=000089014-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089014

0 1
N 3.315144 2.124532 -1.171078
C 2.675337 -0.089896 1.513049
C 3.527285 -0.154305 0.209826
C 1.173357 0.060211 1.190708
C 0.699746 -0.916905 0.119608
C 3.093011 -1.384988 -0.643864
C -0.800496 -1.124477 -0.009389
C 1.585519 -1.561971 -0.689779
C -1.580540 0.174168 -0.397241
C 3.409023 1.104095 -0.558501
C -3.049388 -0.102154 -0.642598
C -4.127385 0.374392 0.046047
C -5.541571 -0.023666 -0.349852
C -4.049442 1.321493 1.231163
H 3.019823 0.740781 2.155382
H 2.848726 -1.034934 2.062951
H 4.596468 -0.264451 0.479171
H 0.967166 1.099930 0.862099
H 0.579294 -0.088681 2.114915
H 3.568742 -2.289625 -0.210444
H 3.495014 -1.290412 -1.670914
H -1.007206 -1.901714 -0.770676
H -1.217538 -1.496504 0.949834
H 1.205338 -2.267328 -1.442354
H -1.445276 0.938767 0.388800
H -1.120999 0.584948 -1.319735
H -3.250489 -0.785863 -1.483661
H -6.148548 0.867710 -0.606326
H -5.548440 -0.704223 -1.219032
H -6.062088 -0.529540 0.488086
H -3.015762 1.567986 1.522799
H -4.557919 0.883253 2.113127
H -4.573409 2.271672 1.005380


