%chk=000177134.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000177134

0 1
 O  -0.3672000       2.566800      0.2714000    
 O    1.818900       3.553600      0.2230000    
 O   -2.180800       1.437600     -0.8650000    
 O   -4.495500      0.1221000     -0.6067000    
 N    2.708600      -2.760200      0.1721000    
 C    1.479600      -2.046400     -0.2049000    
 C    1.600800     -0.5344000     -8.2300000E-02
 C   0.3258000      -2.555500      0.6731000    
 C   0.4147000      0.2441000      5.1000002E-03
 C    2.887300      6.5300003E-02 -0.1091000    
 C    4.129100     -0.7895000     -0.1582000    
 C  -0.9536000      -1.817500      0.3483000    
 C  -0.9008000     -0.4421000      1.5799999E-02
 C    3.848200      -2.232100     -0.5755000    
 C   0.6033000       1.620000      0.1110000    
 C    3.012200       1.453500     -1.3300000E-02
 C    1.858000       2.197600      9.7599998E-02
 C   -2.112300      0.1903000     -0.3121000    
 C   -2.179300      -2.497800      0.4099000    
 C   -3.329100     -0.4977000     -0.2659000    
 C   -3.363900      -1.837000      0.1037000    
 C   0.4035000       3.779900      0.3232000    
 C   -5.207600      0.7793000      0.4387000    
 H    1.251600      -2.269000      -1.257700    
 H   0.5429000      -2.408700       1.739900    
 H   0.1894000      -3.632000      0.5081000    
 H    4.852500     -0.3534000     -0.8573000    
 H    4.583700     -0.7822000      0.8410000    
 H    2.596900      -3.752500     -3.4800000E-02
 H    3.658900      -2.295000      -1.654700    
 H    4.733900      -2.844000     -0.3721000    
 H    3.986000       1.931800     -9.1000004E-03
 H   -2.212700      -3.548100      0.6872000    
 H   -4.306400      -2.375900      0.1412000    
 H   0.1940000       4.288800       1.270900    
 H   9.0700001E-02   4.431000     -0.5012000    
 H   -3.102800       1.646400      -1.092400    
 H   -4.588400       1.552800      0.9041000    
 H   -5.532900      5.5500001E-02   1.192600    
 H   -6.092100       1.253900      5.2000000E-03


%chk=000177134-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000177134

0 1
O -0.057721 2.743558 0.763568
O 2.141859 3.611833 0.463244
O -1.996265 1.622585 -0.827471
O -4.369004 0.581598 -0.389430
N 2.623221 -2.784833 -0.018086
C 1.376561 -2.009803 -0.176072
C 1.656588 -0.506950 -0.110875
C 0.367021 -2.364108 0.942124
C 0.516544 0.348982 0.115462
C 2.972183 0.002978 -0.218832
C 4.157183 -0.929709 -0.447085
C -0.929308 -1.610559 0.699649
C -0.831340 -0.261599 0.220307
C 3.704419 -2.324712 -0.914744
C 0.804766 1.711288 0.300990
C 3.212186 1.403366 -0.087724
C 2.117859 2.219007 0.178265
C -2.025263 0.391567 -0.171907
C -2.185765 -2.216801 0.879435
C -3.291285 -0.231374 0.036531
C -3.384925 -1.522949 0.577220
C 0.704598 3.987910 0.544625
C -5.721072 0.053458 -0.220521
H 0.877946 -2.224959 -1.159347
H 0.829204 -2.096134 1.912900
H 0.175691 -3.454257 0.955936
H 4.850782 -0.487365 -1.188668
H 4.718938 -1.041456 0.501182
H 2.447700 -3.795586 -0.082902
H 3.379475 -2.269487 -1.984055
H 4.546471 -3.037839 -0.857264
H 4.222458 1.815420 -0.164753
H -2.237841 -3.244842 1.254118
H -4.354763 -2.003978 0.735025
H 0.554945 4.656077 1.405329
H 0.400037 4.441583 -0.419589
H -2.938015 1.908989 -0.976725
H -5.936034 -0.148250 0.846453
H -5.861101 -0.872510 -0.810973
H -6.393833 0.839159 -0.594541


