%chk=000091541.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091541

0 1
 O    1.711300     -0.2873000     -0.9734000    
 O    4.169900       1.258700     -5.1000002E-03
 O    2.080600      -3.011300     -0.4277000    
 O  -0.6236000       3.078800     -0.4918000    
 O   -4.194400      0.3124000      0.3715000    
 O   -2.937300      -2.688500     -0.6497000    
 N  -0.1979000      0.8052000     -0.1757000    
 N   -2.395400       1.687800     -5.9799999E-02
 C    1.219900      0.9126000     -0.3593000    
 C    3.276900      0.3807000      0.6769000    
 C    1.972000       1.092600      0.9492000    
 C    2.863000     -0.7568000     -0.2462000    
 C    2.458400      -2.015900      0.5095000    
 C  -0.7383000     -0.4466000      8.9500003E-02
 C   -1.033500       1.939400     -0.2600000    
 C   -2.041900     -0.6839000      0.2807000    
 C   -2.986700      0.4622000      0.2065000    
 C   -2.603000      -2.040100      0.5650000    
 H    1.444400       1.742100      -1.040400    
 H    3.781600      3.7400000E-02   1.584800    
 H    1.448200      0.5989000       1.776800    
 H    2.083700       2.150800       1.205800    
 H    3.634300     -0.9930000     -0.9876000    
 H    1.633500      -1.852000       1.206500    
 H    3.311200      -2.397800       1.081000    
 H  -6.3600004E-02  -1.285900      0.1347000    
 H    4.363400       1.999600      0.5943000    
 H   -3.016700       2.490000     -0.1163000    
 H    1.841400      -3.805800      7.9400003E-02
 H   -3.492700      -1.986300       1.200800    
 H   -1.867200      -2.659600       1.090300    
 H   -3.286800      -3.566300     -0.4197000    


%chk=000091541-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000091541

0 1
O 1.870524 -0.355883 -1.031892
O 4.410878 1.107829 -0.295783
O 1.812188 -2.908583 0.165908
O -0.498952 2.884863 0.126900
O -4.163557 0.016426 0.674356
O -3.841281 -2.465784 -0.701294
N -0.181626 0.579384 -0.184834
N -2.309762 1.412388 0.401737
C 1.257802 0.867678 -0.553848
C 3.397138 0.523056 0.588848
C 2.096735 1.363360 0.657569
C 2.939681 -0.782522 -0.089294
C 2.439274 -1.821484 0.926087
C -0.705582 -0.713011 -0.212054
C -0.969135 1.710652 0.115112
C -2.022022 -0.978974 0.093632
C -2.921865 0.130440 0.411636
C -2.616913 -2.375654 0.100479
H 1.233450 1.598290 -1.378588
H 3.820467 0.346187 1.599934
H 1.556153 1.167148 1.600312
H 2.278351 2.447662 0.598149
H 3.732609 -1.212658 -0.720522
H 1.711068 -1.368648 1.633971
H 3.315354 -2.184510 1.504322
H 0.010540 -1.493599 -0.492765
H 4.619140 2.028308 0.004712
H -2.911880 2.215982 0.609485
H 1.667001 -3.688652 0.757404
H -2.825609 -2.687586 1.147547
H -1.910003 -3.093664 -0.346932
H -4.475466 -1.796338 -0.319792


