%chk=000134458.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134458

0 1
 O    4.429700       1.395500       1.042300    
 N   -2.254600     -0.2695000     -7.0600003E-02
 C   0.3481000      -1.391200      0.6880000    
 C  -0.5286000      -1.970800     -0.4646000    
 C   -1.331100     -0.8095000      -1.091800    
 C  -0.6221000     -0.7697000       1.731200    
 C  -0.3699000      0.2112000      -1.738300    
 C    1.267800     -0.2738000      0.1703000    
 C   -1.591600      0.2534000       1.124700    
 C   0.8973000      0.4876000     -0.9609000    
 C    1.124500      -2.537500       1.372900    
 C   0.2536000      -2.771900      -1.517900    
 C   -3.217400      0.6880000     -0.6057000    
 C    2.460300      6.2100001E-02  0.8371000    
 C    1.734000       1.521700      -1.414300    
 C    3.278600       1.096800      0.3796000    
 C    2.918200       1.823600     -0.7478000    
 C   -4.285400       1.012900      0.3927000    
 C   -4.511400       2.241100      0.8730000    
 H   -1.249800      -2.681000     -3.1099999E-02
 H   -1.957100      -1.228600      -1.891400    
 H  -6.2500000E-02 -0.2894000       2.544600    
 H   -1.213000      -1.571600       2.195800    
 H  -0.8822000       1.156100      -1.947500    
 H  -6.5200001E-02 -0.1841000      -2.717200    
 H   -2.317800      0.4821000       1.913300    
 H   -1.066300       1.192100      0.9101000    
 H    1.945500      -2.904000      0.7466000    
 H    1.556100      -2.224500       2.330200    
 H   0.4631000      -3.384300       1.590700    
 H    1.097900      -2.216400      -1.935500    
 H   0.6478000      -3.698300      -1.087700    
 H  -0.4032000      -3.058200      -2.346400    
 H   -3.717800      0.2596000      -1.483100    
 H   -2.725000       1.608900     -0.9396000    
 H    2.766100     -0.4734000       1.731700    
 H    1.460000       2.100100      -2.293600    
 H    3.546200       2.630100      -1.116000    
 H   -4.917100      0.1972000      0.7363000    
 H    4.870500       2.136000      0.5912000    
 H   -5.304800       2.411700       1.592600    
 H   -3.914200       3.091100      0.5624000    


%chk=000134458-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000134458

0 1
O 4.595310 1.216882 1.037804
N -2.222094 -0.170152 -0.014271
C 0.378210 -1.383004 0.702030
C -0.537924 -1.942194 -0.437966
C -1.336159 -0.765841 -1.056155
C -0.570015 -0.725116 1.763746
C -0.358178 0.228862 -1.752038
C 1.320352 -0.297833 0.143427
C -1.492413 0.353268 1.167716
C 0.935101 0.489371 -0.984458
C 1.145504 -2.540988 1.389476
C 0.220340 -2.751663 -1.513232
C -3.223341 0.784579 -0.543520
C 2.549594 -0.016527 0.786876
C 1.797011 1.521095 -1.428310
C 3.391517 1.017130 0.329645
C 3.021431 1.799770 -0.788238
C -4.403923 0.945411 0.395801
C -4.936746 2.132467 0.778371
H -1.283471 -2.606748 0.044632
H -2.012803 -1.175457 -1.833043
H 0.038413 -0.277455 2.573348
H -1.191594 -1.526292 2.210382
H -0.879244 1.186804 -1.950309
H -0.102268 -0.180892 -2.751213
H -2.240211 0.660195 1.922285
H -0.897748 1.266061 0.916328
H 1.953213 -2.938154 0.750336
H 1.595923 -2.219607 2.346344
H 0.447034 -3.367426 1.619232
H 1.079347 -2.191130 -1.924557
H 0.608229 -3.698619 -1.098413
H -0.453745 -3.010715 -2.351897
H -3.590229 0.372385 -1.506865
H -2.795448 1.794969 -0.765925
H 2.882329 -0.593526 1.654155
H 1.501801 2.122270 -2.297672
H 3.670608 2.607052 -1.151895
H -4.835807 0.000434 0.757311
H 5.113638 1.959450 0.639923
H -5.812438 2.184936 1.434953
H -4.511908 3.087149 0.442156


