%chk=000127452.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127452

0 1
 O   -1.242100      0.9997000     -4.1099999E-02
 O  -0.5052000      -1.182000      0.3407000    
 O   -3.112500      -2.141900     -0.2505000    
 O   -5.191000     -0.1989000      0.2694000    
 O   -3.622900       1.862200       1.280400    
 O   0.7747000      0.7473000       1.726100    
 O   0.6167000      -2.518200      -1.830500    
 O  -0.4426000       3.480700     -0.9046000    
 O    2.231600      -4.311900     -0.5209000    
 O    3.841800      0.2091000       3.126700    
 O    4.497900      0.3019000      -1.599500    
 N    2.981900       1.294900     -0.1377000    
 C   -2.862300     -0.8070000      0.1891000    
 C   -3.951100      0.1153000     -0.3586000    
 C   -1.483600     -0.3789000     -0.3187000    
 C   -3.597800       1.583800     -0.1211000    
 C   -2.193400       1.873200     -0.6622000    
 C   0.8192000     -0.8345000     -8.6199999E-02
 C    1.570400     -0.2979000       1.149200    
 C    1.459400      -2.050900     -0.7758000    
 C   -1.747700       3.303800     -0.3834000    
 C    2.970600      0.2634000      0.8690000    
 C    1.667800      -3.215200      0.1920000    
 C   -4.373400      -2.607100      0.2047000    
 C    3.591900      0.8626000       2.116800    
 C    3.748300       1.224600      -1.290800    
 C    3.553300       2.421700      -2.182300    
 H   -2.865200     -0.8025000       1.287800    
 H   -4.079700     -6.7599997E-02  -1.433100    
 H   -1.407300     -0.5616000      -1.399500    
 H   -4.339700       2.238000     -0.5926000    
 H   -2.156400       1.694200      -1.744900    
 H   0.7646000     -4.0500000E-02 -0.8434000    
 H    1.629100      -1.067000       1.927300    
 H    2.415700      -1.772000      -1.231600    
 H   -1.689500       3.504100      0.6909000    
 H   -2.419100       4.035300     -0.8433000    
 H    3.633400     -0.5490000      0.5505000    
 H   -5.863400      0.4016000     -9.5200002E-02
 H   -4.509700       1.631000       1.605800    
 H   0.7170000      -3.555300      0.6148000    
 H    2.355800      -2.955900       1.000500    
 H   -4.324100      -3.701600      0.1980000    
 H   -5.170200      -2.349100     -0.4984000    
 H   -4.591800      -2.316700       1.237700    
 H  -8.4399998E-02  0.3606000       1.966800    
 H    2.413000       2.121500      2.3900000E-02
 H    1.057300      -3.282400      -2.239900    
 H  -0.4846000       3.331800      -1.864600    
 H    3.797000       1.947400       2.097900    
 H    2.348300      -5.036600      0.1169000    
 H    3.725000       3.342300      -1.617400    
 H    2.533600       2.421200      -2.577700    
 H    4.261300       2.381900      -3.014700    


%chk=000127452-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127452

0 1
O -1.257424 1.075917 -0.411626
O -0.590496 -0.946802 0.543108
O -3.485741 -1.879181 0.335450
O -5.314227 0.172040 -0.219081
O -3.882821 2.459019 0.143154
O 1.035042 0.397937 2.150561
O 0.371476 -2.082289 -1.989500
O -0.281921 3.403217 -1.972343
O 1.229657 -4.448266 -1.088854
O 4.118173 -1.252638 2.761398
O 3.965411 1.158977 -1.485134
N 2.937311 1.421605 0.580057
C -2.981684 -0.506231 0.222728
C -3.955147 0.171222 -0.766804
C -1.562424 -0.369532 -0.352606
C -3.596892 1.647694 -1.037243
C -2.099265 1.780374 -1.394052
C 0.813580 -0.848244 0.029680
C 1.683877 -0.594283 1.285286
C 1.198791 -2.097261 -0.773402
C -1.633940 3.242124 -1.420816
C 3.067760 0.010056 0.928702
C 0.996154 -3.432958 -0.040353
C -3.069452 -2.578130 1.561414
C 4.075065 -0.211105 2.067377
C 3.348910 1.904184 -0.660001
C 2.980232 3.351944 -0.940722
H -3.013944 0.010519 1.205912
H -3.922429 -0.402064 -1.718426
H -1.465426 -0.822846 -1.361592
H -4.206166 2.000206 -1.899054
H -1.951137 1.311632 -2.397201
H 0.862629 0.031140 -0.638806
H 1.846168 -1.529170 1.857883
H 2.268978 -2.014424 -1.063327
H -1.579620 3.622821 -0.391280
H -2.370221 3.850162 -1.986022
H 3.502314 -0.487436 0.031940
H -5.483343 -0.745870 0.120746
H -4.757095 2.135866 0.492036
H -0.038392 -3.497948 0.349217
H 1.725174 -3.545776 0.785939
H -3.579638 -3.553881 1.535198
H -3.386325 -2.014491 2.462682
H -1.974229 -2.714619 1.586564
H 0.054244 0.287366 2.014445
H 2.291151 1.958610 1.167211
H 0.482028 -2.979814 -2.404869
H -0.266748 3.086497 -2.911177
H 4.794578 0.632408 2.212562
H 1.078857 -5.356299 -0.730868
H 3.131936 3.991860 -0.053010
H 1.913207 3.420652 -1.231612
H 3.599344 3.728407 -1.768770


