%chk=000051069.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051069

0 1
 N   0.7978000      0.1856000      0.2036000    
 N   -3.785900      0.8680000      0.2456000    
 C    1.862800     -0.5514000     -0.2560000    
 C   0.8551000       1.602300      0.5147000    
 C    3.179900      7.7900000E-02 -0.5643000    
 C    2.070400       2.290900     -0.1048000    
 C    3.330000       1.448600      9.9200003E-02
 C  -0.2931000     -0.6203000      0.3809000    
 C   7.3600002E-02  -1.900200      2.5599999E-02
 C    1.432400      -1.858100     -0.3760000    
 C   -1.588600     -0.1124000      0.8817000    
 C   -2.522100      0.3408000     -0.2577000    
 C  -0.7846000      -3.101300      5.6299999E-02
 C   -4.627700       1.329500     -0.8488000    
 H   0.8905000       1.680100       1.607400    
 H  -5.9099998E-02   2.081500      0.1527000    
 H    3.996800     -0.5766000     -0.2400000    
 H    3.266300      0.1890000      -1.652200    
 H    2.200500       3.283100      0.3410000    
 H    1.904000       2.438900      -1.179300    
 H    3.512300       1.322700       1.174100    
 H    4.201800       1.966100     -0.3165000    
 H    2.035900      -2.686700     -0.7213000    
 H   -2.089600     -0.9014000       1.458100    
 H   -1.437700      0.7111000       1.590400    
 H   -2.717000     -0.5133000     -0.9188000    
 H   -2.013600       1.104100     -0.8602000    
 H   -1.682600      -2.952800     -0.5521000    
 H  -0.2583000      -3.978200     -0.3348000    
 H   -1.095300      -3.327000       1.081600    
 H   -3.602600       1.644000      0.8810000    
 H   -4.868200      0.5123000      -1.536600    
 H   -4.151500       2.141000      -1.408800    
 H   -5.572300       1.708500     -0.4466000    


%chk=000051069-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000051069

0 1
N 0.822531 0.205408 0.157015
N -3.825880 0.876114 0.233474
C 1.912148 -0.560335 -0.287902
C 0.906412 1.627353 0.541217
C 3.237989 0.082910 -0.617684
C 2.134381 2.302690 -0.104177
C 3.404614 1.445481 0.100452
C -0.291298 -0.635834 0.367667
C 0.095363 -1.945064 0.026905
C 1.478575 -1.887917 -0.379975
C -1.622010 -0.113411 0.840849
C -2.522463 0.433018 -0.298093
C -0.776163 -3.177612 0.060855
C -4.777130 1.360534 -0.782844
H 0.980713 1.708434 1.646429
H -0.021835 2.142925 0.232551
H 4.061382 -0.603619 -0.347155
H 3.319799 0.252052 -1.712859
H 2.258414 3.307351 0.341581
H 1.958019 2.440453 -1.189253
H 3.569143 1.285414 1.184943
H 4.293015 1.974003 -0.292060
H 2.088526 -2.729173 -0.709972
H -2.178345 -0.924637 1.343776
H -1.485333 0.682721 1.603711
H -2.702592 -0.377746 -1.030222
H -1.975843 1.240758 -0.852127
H -1.051404 -3.517268 -0.957203
H -0.258635 -4.022182 0.553636
H -1.717739 -2.997402 0.610266
H -3.711629 1.543637 1.008181
H -5.032149 0.533310 -1.471350
H -4.397463 2.207551 -1.407249
H -5.712813 1.686385 -0.294283


