%chk=000165420.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000165420

0 1
 O    1.410900       1.106500     -0.3777000    
 O   0.6043000      -2.920200     -0.1955000    
 O    3.255800      -1.919600      0.5333000    
 O    3.892000       2.208900     -2.8300000E-02
 O   -2.664200      -1.544800      -1.464300    
 O   -2.303200       1.814200       1.364400    
 N   -1.501200      -1.013100      0.4806000    
 N  -0.8212000       1.695000     -0.4275000    
 C  -0.2364000     -0.6706000     -0.1335000    
 C   0.8658000      -1.623600      0.3449000    
 C    2.247000      -1.155200     -0.1220000    
 C   0.1305000      0.7873000      0.1614000    
 C    2.457900      0.3262000      0.2005000    
 C    3.779000      0.8439000     -0.3601000    
 C   -2.607000      -1.421500     -0.2436000    
 C   -1.961400       2.132300      0.2284000    
 C   -3.781400      -1.739400      0.6426000    
 C   -2.767400       3.093700     -0.6036000    
 H  -0.3366000     -0.7958000      -1.220400    
 H   0.8434000      -1.722500       1.437700    
 H    2.346500      -1.334800      -1.199400    
 H   0.1451000      0.9704000       1.244000    
 H    2.460700      0.4961000       1.286000    
 H   -1.568300     -0.9527000       1.492800    
 H    3.813300      0.7571000      -1.451200    
 H    4.635300      0.3110000      6.3000001E-02
 H  -0.6385000       2.016300      -1.373400    
 H    1.323500      -3.506200      9.6500002E-02
 H    3.175100      -1.766100       1.490100    
 H    3.128800       2.672300     -0.4138000    
 H   -4.676700      -1.881300      3.1099999E-02
 H   -3.578800      -2.656500       1.202400    
 H   -3.961400     -0.9174000       1.341300    
 H   -3.741400       3.259400     -0.1350000    
 H   -2.236300       4.046500     -0.6775000    
 H   -2.926100       2.685400      -1.605800    


%chk=000165420-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000165420

0 1
O 1.222745 0.997916 -0.469623
O 0.688282 -3.053521 0.480826
O 3.319640 -1.902795 0.780529
O 3.706302 2.386735 -0.290764
O -2.841410 -0.508034 -1.272181
O -0.658297 3.244917 1.079767
N -1.556540 -1.438886 0.429851
N -1.111314 1.453583 -0.338100
C -0.279222 -0.878803 -0.051061
C 0.882369 -1.613540 0.645204
C 2.245935 -1.164989 0.081239
C -0.066593 0.643289 0.209703
C 2.389102 0.367119 0.186467
C 3.608512 0.950545 -0.534285
C -2.734950 -1.304710 -0.279629
C -1.352494 2.736700 0.148987
C -3.905822 -2.154570 0.189734
C -2.496199 3.477590 -0.532433
H -0.211857 -1.031185 -1.147288
H 0.864288 -1.359358 1.734134
H 2.338430 -1.493528 -0.968866
H 0.055770 0.868901 1.290865
H 2.414918 0.674574 1.259979
H -1.481991 -2.211113 1.097478
H 3.525303 0.725002 -1.618986
H 4.539820 0.508393 -0.144758
H -1.748727 1.001708 -1.015943
H 1.551787 -3.491062 0.706989
H 3.456807 -1.505307 1.680343
H 2.817895 2.782718 -0.492803
H -4.761155 -1.497184 0.420627
H -4.218514 -2.819221 -0.634124
H -3.675530 -2.768546 1.076540
H -3.079010 4.021423 0.228570
H -2.078221 4.228872 -1.226947
H -3.162658 2.807567 -1.101640


