%chk=000047091.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047091

0 1
 N  -0.7010000      0.7733000      0.3443000    
 N    4.636200     -0.5511000     -0.2501000    
 C   0.6626000      0.6434000      0.2263000    
 C   -1.323200     -0.4430000      0.1892000    
 C   0.9300000     -0.7047000     -1.2900000E-02
 C  -0.3253000      -1.391500     -3.6400001E-02
 C   -1.389500       2.023500      0.5974000    
 C   -1.760700       2.746800     -0.6952000    
 C    1.670100       1.611200      0.3127000    
 C    2.272400      -1.108000     -0.1738000    
 C   -2.683400     -0.7704000      0.2316000    
 C  -0.7046000      -2.736500     -0.2293000    
 C    3.290600     -0.1517000     -9.0499997E-02
 C    2.991600       1.187400      0.1492000    
 C   -3.033900      -2.109200      3.7500001E-02
 C   -2.060900      -3.079400     -0.1897000    
 C   -2.471100       4.059900     -0.4103000    
 H   -2.281300       1.810100       1.197000    
 H  -0.7459000       2.649100       1.225600    
 H   -2.409300       2.111700      -1.310400    
 H  -0.8605000       2.945700      -1.288900    
 H    1.450000       2.657700      0.4942000    
 H    2.508300      -2.152500     -0.3607000    
 H   -3.451100     -2.3499999E-02  0.4028000    
 H   4.2500000E-02  -3.504700     -0.4077000    
 H    3.788500       1.925400      0.2119000    
 H   -4.082100      -2.396100      6.3199997E-02
 H   -2.356400      -4.114600     -0.3383000    
 H   -3.395800       3.891600      0.1507000    
 H   -2.729000       4.562500      -1.347700    
 H   -1.833000       4.732700      0.1715000    
 H    5.377500      0.1345000     -0.1935000    
 H    4.858100      -1.521800     -0.4267000    


%chk=000047091-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000047091

0 1
N -0.740577 0.796905 0.392476
N 4.680944 -0.571275 -0.271690
C 0.658562 0.645105 0.244077
C -1.344198 -0.458465 0.211876
C 0.957577 -0.735742 -0.012192
C -0.318209 -1.441512 -0.032808
C -1.439163 2.066482 0.607386
C -1.772612 2.820693 -0.704607
C 1.685619 1.607469 0.322842
C 2.296585 -1.152083 -0.184804
C -2.711921 -0.811517 0.251736
C -0.683264 -2.793071 -0.231370
C 3.339972 -0.192279 -0.104232
C 3.017462 1.180774 0.149304
C -3.048351 -2.167969 0.051893
C -2.047471 -3.152128 -0.187212
C -2.500154 4.153484 -0.429802
H -2.371491 1.865370 1.168380
H -0.813136 2.708047 1.257215
H -2.397528 2.169294 -1.344941
H -0.834708 3.005858 -1.262244
H 1.472455 2.665064 0.511470
H 2.532780 -2.205276 -0.379276
H -3.494406 -0.065687 0.427995
H 0.082668 -3.554747 -0.417468
H 3.829798 1.916021 0.206927
H -4.102205 -2.468339 0.078829
H -2.343482 -4.195704 -0.339764
H -3.452343 3.987562 0.109096
H -2.735574 4.679322 -1.372177
H -1.878945 4.830750 0.186704
H 5.426657 0.114013 -0.208517
H 4.929062 -1.538619 -0.452102


