%chk=000043527.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043527

1 1
 O   0.4284000      -1.526900     -0.8126000    
 O   -3.148100      0.3004000      0.6404000    
 O   -1.823000      7.0900001E-02  -1.233800    
 N    2.291100      0.4299000      5.0700001E-02
 C   0.8713000      0.4545000      0.4832000    
 C   0.2769000     -0.9533000      0.4865000    
 C    2.891500       1.842300      7.1000002E-02
 C    3.128500     -0.4582000      0.9810000    
 C    2.416800     -0.1215000      -1.376100    
 C   -1.205000     -0.9915000      0.8707000    
 C   -2.062900     -0.1535000     -5.5399999E-02
 C   -4.065400       1.106900     -0.1056000    
 H   0.3433000       1.119000     -0.2098000    
 H   0.8239000      0.8964000       1.485800    
 H   0.8007000      -1.598900       1.198100    
 H    2.805000       2.233200       1.089100    
 H    3.942400       1.785600     -0.2277000    
 H    2.324000       2.462400     -0.6291000    
 H    2.861900      -1.508200      0.8401000    
 H    4.182800     -0.3229000      0.7190000    
 H    2.952600     -0.1385000       2.012200    
 H    1.593800      0.2578000      -1.989300    
 H    3.357400      0.2573000      -1.793000    
 H    2.508100      -1.210400      -1.367300    
 H   -1.314600     -0.6204000       1.896300    
 H   -1.589800      -2.016400      0.8238000    
 H   7.7500001E-02  -2.433000     -0.7768000    
 H   -4.484400      0.5327000     -0.9375000    
 H   -3.565600       2.009100     -0.4709000    
 H   -4.879200       1.402300      0.5620000    


%chk=000043527-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000043527

1 1
O 0.223522 -1.539390 -0.324753
O -3.283073 -0.253929 0.214807
O -1.666674 1.321103 -0.353879
N 2.415780 0.361733 -0.053767
C 1.030243 0.556360 0.610832
C 0.232417 -0.731095 0.902072
C 3.227674 1.634715 0.192175
C 3.166777 -0.831738 0.530126
C 2.254171 0.172355 -1.569060
C -1.201348 -0.387332 1.380434
C -2.040075 0.329967 0.321807
C -4.242858 0.382109 -0.736659
H 0.444240 1.217530 -0.049637
H 1.211055 1.074837 1.568894
H 0.723352 -1.303416 1.717878
H 3.448749 1.724112 1.266962
H 4.166812 1.576488 -0.379213
H 2.641066 2.503393 -0.143432
H 2.633289 -1.752129 0.253872
H 4.183539 -0.846133 0.108170
H 3.222856 -0.726513 1.624810
H 1.807402 1.086297 -1.989626
H 3.250663 0.001088 -2.005440
H 1.587875 -0.683588 -1.736444
H -1.147141 0.262897 2.275436
H -1.722636 -1.309311 1.690344
H -0.417002 -2.290108 -0.242103
H -3.828230 0.358601 -1.757148
H -4.430037 1.424888 -0.434408
H -5.152509 -0.226691 -0.658049


