%chk=000021062.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021062

0 1
 O  -0.1220000       1.492700      0.8924000    
 O    3.599600      -1.956800     -0.7833000    
 N   -1.956600     -0.3399000      0.9698000    
 C   0.3808000     -0.7456000      0.2911000    
 C    1.360800      -1.638800     -0.1469000    
 C  -0.9226000      -1.199400      0.5261000    
 C    2.087300       1.143600      0.2569000    
 C    3.067300      0.2504000     -0.1814000    
 C   0.7083000      0.6782000      0.5093000    
 C   -1.240600      -2.542600      0.3229000    
 C    2.739800      -1.173300     -0.3995000    
 C    1.037500      -2.985900     -0.3494000    
 C  -0.2625000      -3.434000     -0.1137000    
 C    2.410600       2.490700      0.4595000    
 C    4.370500      0.7043000     -0.4172000    
 C   -2.621700      -3.062700      0.5631000    
 C   -2.899400      0.4428000      0.2830000    
 C    3.710500       2.938900      0.2232000    
 C    4.688300       2.047600     -0.2141000    
 C   -3.826000       1.211900      0.9928000    
 C   -2.917100      0.4568000      -1.114600    
 C   -4.762600       1.988400      0.3106000    
 C   -3.853700       1.233500      -1.796800    
 C   -4.776400       1.999400      -1.084000    
 H    1.782100      -3.700500     -0.6900000    
 H  -0.4950000      -4.483000     -0.2778000    
 H   -2.003100     -0.2709000       1.982300    
 H    1.668200       3.207500      0.7999000    
 H    5.150900      2.9600000E-02 -0.7586000    
 H   -2.965800      -2.803900       1.570100    
 H   -3.318700      -2.655000     -0.1760000    
 H   -2.663500      -4.154800      0.4856000    
 H    3.960700       3.984100      0.3804000    
 H    5.699600       2.399000     -0.3973000    
 H   -3.827100       1.213400       2.080000    
 H   -2.209700     -0.1296000      -1.695100    
 H   -5.481100       2.584800      0.8653000    
 H   -3.864600       1.242300      -2.882800    
 H   -5.505600       2.604100      -1.615200    


%chk=000021062-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021062

0 1
O 0.268313 1.818990 1.015796
O 3.751613 -2.100794 -0.714136
N -1.759113 0.274703 0.565925
C 0.544472 -0.442724 0.184086
C 1.473674 -1.460497 -0.217471
C -0.876014 -0.746713 0.223263
C 2.500007 1.184862 0.406847
C 3.418048 0.183869 -0.020944
C 1.045983 0.891900 0.551900
C -1.313663 -2.107269 0.003520
C 2.940299 -1.192042 -0.339147
C 1.015445 -2.754407 -0.523887
C -0.353715 -3.066188 -0.379892
C 2.975892 2.484608 0.714288
C 4.795794 0.492214 -0.138567
C -2.730340 -2.564006 0.290247
C -3.087035 0.485261 0.096606
C 4.346445 2.785699 0.590317
C 5.259950 1.787420 0.162952
C -3.985274 1.215177 0.921151
C -3.504273 0.083915 -1.201901
C -5.282229 1.522152 0.460345
C -4.808031 0.385446 -1.649263
C -5.705687 1.101884 -0.823098
H 1.747150 -3.507208 -0.830716
H -0.688394 -4.098249 -0.537549
H -1.256053 1.111884 0.948552
H 2.251858 3.234477 1.046387
H 5.474858 -0.300984 -0.466790
H -3.152230 -2.038284 1.164472
H -3.422980 -2.374356 -0.550176
H -2.739555 -3.647946 0.496394
H 4.708321 3.792483 0.825040
H 6.325092 2.024599 0.069442
H -3.659428 1.530067 1.918803
H -2.795702 -0.422759 -1.866024
H -5.965243 2.085116 1.106162
H -5.116592 0.076273 -2.654371
H -6.714264 1.338727 -1.177966


