%chk=000100533.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100533

0 1
 O   -1.352300      0.3551000       1.033300    
 O   -3.363300       2.006100     -0.7132000    
 O   -4.020000      -1.776900      8.2400002E-02
 O   -1.882700      -2.185500      0.7612000    
 O    1.617700       2.719700      0.6537000    
 O    4.528500     -0.7707000     -4.8999999E-02
 N   0.7422000      0.6485000      3.2299999E-02
 N    3.058200      0.9705000      0.2994000    
 C  -0.6211000       1.089600      4.3400001E-02
 C   -1.329200      0.8531000      -1.277800    
 C   -2.772000      0.7173000     -0.8471000    
 C   -2.665900      8.5400000E-02  0.5293000    
 C   -2.779600      -1.403900      0.4821000    
 C   0.9892000     -0.6677000     -0.2999000    
 C    1.779300       1.535800      0.3501000    
 C    2.214200      -1.205500     -0.3476000    
 C    3.379000     -0.3390000     -2.4700001E-02
 C    2.477900      -2.632200     -0.7079000    
 H  -0.6825000       2.148200      0.3203000    
 H   -1.028400     -6.6500001E-02  -1.787900    
 H   -1.157000       1.683600      -1.970700    
 H   -3.373400      0.1537000      -1.565500    
 H   -3.391300      0.4750000       1.251300    
 H   0.1329000      -1.293400     -0.5181000    
 H   -2.876400       2.506000     -3.6800001E-02
 H    3.834300       1.586600      0.5248000    
 H    3.115300      -2.690700      -1.596200    
 H    1.553200      -3.177000     -0.9257000    
 H    2.981200      -3.148000      0.1163000    
 H   -4.114300      -2.752500      4.2800002E-02


%chk=000100533-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100533

0 1
O -1.394204 0.365164 1.048266
O -3.507987 2.161793 -0.497083
O -4.037052 -1.991558 0.444957
O -1.858812 -2.177118 -0.337527
O 1.617706 2.776879 0.440732
O 4.652058 -0.738590 -0.074750
N 0.766958 0.618960 -0.017550
N 3.089237 0.975027 0.178528
C -0.606375 1.133441 0.031511
C -1.411950 1.019753 -1.282586
C -2.873577 0.882149 -0.800355
C -2.708719 0.008123 0.489373
C -2.773669 -1.482646 0.160767
C 1.017395 -0.743906 -0.237628
C 1.815331 1.547924 0.224417
C 2.282857 -1.278470 -0.273527
C 3.436283 -0.390044 -0.063235
C 2.550933 -2.745521 -0.501508
H -0.509149 2.176347 0.381622
H -1.108588 0.117985 -1.842372
H -1.281157 1.902228 -1.927493
H -3.541990 0.420487 -1.542304
H -3.490666 0.257059 1.223525
H 0.122986 -1.365960 -0.346298
H -2.940515 2.686794 0.124368
H 3.869551 1.620051 0.339828
H 3.190978 -2.892745 -1.390366
H 1.611702 -3.306634 -0.640360
H 3.101784 -3.179314 0.352766
H -4.087649 -2.952956 0.188883


