%chk=000135328.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135328

0 1
 N    2.111200      0.3483000     -4.0199999E-02
 N   -2.400500      -1.352200     -0.3691000    
 C    1.246600     -0.6916000      0.5297000    
 C    1.757100      -2.049400      1.7400000E-02
 C   0.7765000      -3.161500      0.3654000    
 C  -0.2250000     -0.4701000      0.2395000    
 C  -0.5513000      -2.912500     -0.3404000    
 C   -1.071600      -1.515000     -0.1341000    
 C    3.503600      8.5600004E-02  0.2800000    
 C  -0.8227000      0.7808000      0.4272000    
 C   -2.192300      0.9713000      0.1991000    
 C    4.395500       1.189300     -0.2857000    
 C   -2.953100     -0.1378000     -0.2080000    
 C    5.865000      0.9433000      5.8600001E-02
 C   -2.802600       2.226200      0.3696000    
 C   -4.313600      4.7200002E-02 -0.4389000    
 C    6.763400       2.018800     -0.5311000    
 C   -4.164900       2.385700      0.1333000    
 C   -4.921500       1.293800     -0.2725000    
 H    1.341100     -0.6761000       1.624800    
 H    2.705700      -2.328400      0.4896000    
 H    1.910400      -2.037700      -1.070500    
 H   0.6273000      -3.200900       1.451800    
 H    1.180200      -4.133000      5.8699999E-02
 H   -1.291200      -3.637900      1.7400000E-02
 H  -0.4309000      -3.072700      -1.418900    
 H    1.996100      0.3757000      -1.053400    
 H    3.872800     -0.8415000     -0.1680000    
 H    3.644300      2.8800000E-02   1.366100    
 H  -0.2140000       1.620900      0.7581000    
 H    4.085200       2.161800      0.1173000    
 H    4.279100       1.240200      -1.375900    
 H    6.180200     -3.4299999E-02 -0.3243000    
 H    5.994100      0.9225000       1.147100    
 H   -2.218400       3.087400      0.6862000    
 H   -4.927800     -0.7939000     -0.7552000    
 H    7.808700       1.823900     -0.2713000    
 H    6.683300       2.041900      -1.622600    
 H    6.496200       3.007800     -0.1456000    
 H   -4.632300       3.356600      0.2651000    
 H   -5.985300       1.407400     -0.4596000    


%chk=000135328-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000135328

0 1
N 2.174333 0.029723 -0.182368
N -2.505361 -1.406504 -0.133016
C 1.305702 -1.044720 0.356411
C 1.609601 -2.473731 -0.178264
C 0.595320 -3.489240 0.391016
C -0.173844 -0.679297 0.164859
C -0.826873 -3.170975 -0.116970
C -1.190405 -1.695605 -0.013284
C 3.599419 -0.009673 0.209939
C -0.581010 0.657827 0.196822
C -1.961957 1.004444 0.066373
C 4.331988 1.268090 -0.246211
C -2.907758 -0.079541 -0.093760
C 5.828288 1.275252 0.141300
C -2.442352 2.354083 0.091603
C -4.302272 0.220213 -0.219660
C 6.556544 2.559229 -0.310853
C -3.808152 2.620503 -0.034030
C -4.743304 1.546037 -0.190492
H 1.498019 -1.067148 1.452526
H 2.642842 -2.756757 0.097891
H 1.554114 -2.470917 -1.287173
H 0.619535 -3.446395 1.499067
H 0.872997 -4.521256 0.105999
H -1.594800 -3.756900 0.418670
H -0.911395 -3.463961 -1.184023
H 2.056224 0.135083 -1.200592
H 4.148980 -0.899416 -0.187294
H 3.641126 -0.081915 1.315816
H 0.183296 1.433535 0.317709
H 3.820306 2.145883 0.194372
H 4.241585 1.370986 -1.348901
H 6.328295 0.390137 -0.302852
H 5.920455 1.165304 1.241262
H -1.723095 3.173308 0.212660
H -4.994629 -0.619089 -0.339120
H 7.621900 2.545144 -0.016118
H 6.511662 2.674840 -1.410295
H 6.092563 3.456931 0.139192
H -4.172090 3.653763 -0.013245
H -5.811196 1.771425 -0.288270


