%chk=000027379.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027379

0 1
 O    2.801600     -0.3417000      -1.077600    
 O   -2.663300      -1.686700       1.240700    
 O   -5.343800      -1.698600       1.587200    
 N   -4.751700      -1.020000      0.5138000    
 C  -0.5980000      0.6953000     -0.2100000    
 C   -1.271000       1.793600      0.5457000    
 C   -1.341500     -0.3105000     -0.8272000    
 C   -1.598400       2.996400     -0.3490000    
 C   0.7942000      0.6852000     -0.2944000    
 C    1.433300     -0.3308000     -0.9954000    
 C   -2.832800     -0.3209000     -0.7505000    
 C  -0.6927000      -1.326500      -1.528900    
 C    4.862300     -0.4698000      0.1350000    
 C    3.513900      0.2257000      1.3100000E-02
 C   0.6996000      -1.336600      -1.613300    
 C    5.677300      8.1400000E-02   1.301500    
 C   -2.313400       4.096500      0.4194000    
 C   -3.380300      -1.086700      0.4439000    
 C    7.004900     -0.6453000       1.446100    
 H   -2.170000       1.437000       1.060900    
 H  -0.6115000       2.126100       1.359400    
 H  -0.6736000       3.404000     -0.7759000    
 H   -2.222900       2.691100      -1.196400    
 H    1.347600       1.497400      0.1682000    
 H   -3.236300     -0.7999000      -1.653700    
 H   -3.257900      0.6876000     -0.7606000    
 H   -1.258400      -2.118500      -2.012700    
 H    5.417800     -0.3562000     -0.8043000    
 H    4.703000      -1.548400      0.2600000    
 H    2.979600      8.6999997E-02  0.9622000    
 H    3.659700       1.296500     -0.1704000    
 H    1.201200      -2.130200      -2.159700    
 H    5.865400       1.150900       1.151800    
 H    5.111000     -2.1100000E-02   2.234500    
 H   -3.263400       3.735400      0.8260000    
 H   -1.698500       4.457700       1.249700    
 H   -2.525900       4.943600     -0.2402000    
 H    6.849800      -1.712900       1.631800    
 H    7.611200     -0.5382000      0.5409000    
 H    7.572900     -0.2335000       2.286100    
 H   -5.355200     -0.4359000     -5.3399999E-02
 H   -5.566300      -2.541100       1.156100    


%chk=000027379-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000027379

0 1
O 2.587626 -0.938639 -0.517263
O -4.157033 -0.053245 1.200278
O -5.071096 -2.528466 0.961461
N -4.379456 -1.887908 -0.127104
C -0.804254 0.659569 -0.023158
C -1.416445 1.840994 0.719571
C -1.573924 -0.181510 -0.878632
C -1.450795 3.134573 -0.145347
C 0.588209 0.419117 0.108284
C 1.220199 -0.634660 -0.594114
C -3.083803 -0.004349 -1.059078
C -0.921710 -1.231060 -1.578101
C 4.861038 -0.647724 0.253132
C 3.433882 -0.106553 0.358943
C 0.457486 -1.467397 -1.447909
C 5.851104 0.143839 1.139251
C -2.083212 4.322880 0.609384
C -3.895025 -0.621931 0.080153
C 7.294811 -0.391896 1.029911
H -2.439626 1.599309 1.060468
H -0.823607 2.051364 1.631203
H -0.419632 3.389467 -0.460683
H -2.017191 2.941869 -1.078886
H 1.164630 1.070197 0.773697
H -3.393517 -0.458037 -2.019253
H -3.365174 1.061714 -1.098839
H -1.506071 -1.874403 -2.248793
H 5.183897 -0.604535 -0.804814
H 4.862739 -1.715120 0.546220
H 3.060965 -0.167895 1.403157
H 3.384756 0.952422 0.027627
H 0.958649 -2.275027 -1.989426
H 5.832389 1.214760 0.850555
H 5.519621 0.098574 2.196779
H -3.123794 4.094207 0.906250
H -1.517001 4.553949 1.531594
H -2.099094 5.234928 -0.015161
H 7.348940 -1.451557 1.342330
H 7.662042 -0.330220 -0.011581
H 7.988140 0.185172 1.668408
H -4.186704 -2.533614 -0.890429
H -5.053457 -1.784754 1.650317


