%chk=000072750.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072750

0 1
 O   -2.600500       1.094600     -0.6145000    
 O    2.599900       1.095300      0.6124000    
 O   -2.684600       3.644800     -0.6351000    
 O    2.682900       3.645400      0.6353000    
 O   -5.509600      -1.766200     -0.1406000    
 O    5.510300      -1.765500      0.1429000    
 O   -7.438700      -1.568900       1.876400    
 O    7.442500      -1.567900      -1.871200    
 N   -2.733000      -1.488800     -0.6453000    
 N    2.732900      -1.488400      0.6434000    
 C  -0.6796000     -0.1907000     -0.1618000    
 C   0.6797000     -0.1904000      0.1583000    
 C   -1.359000      -1.404200     -0.3222000    
 C    1.359600      -1.403900      0.3182000    
 C  -0.6801000       2.355500     -0.1608000    
 C   0.6791000       2.355600      0.1597000    
 C   -1.409100       1.082300     -0.3330000    
 C    1.408700       1.082700      0.3308000    
 C  -0.6776000      -2.611100     -0.1622000    
 C   0.6787000      -2.611100      0.1574000    
 C   -1.360000       3.568900     -0.3206000    
 C    1.358300       3.569300      0.3210000    
 C   -3.414200      -2.733900     -0.8058000    
 C    3.414100      -2.733400      0.8050000    
 C  -0.6792000       4.775900     -0.1594000    
 C   0.6770000       4.776100      0.1608000    
 C   -4.865100      -2.487500      -1.183100    
 C    4.864400      -2.486700       1.184400    
 C   -6.873000      -1.511500     -0.4491000    
 C    6.873200      -1.510600      0.4534000    
 C   -7.510300     -0.7635000      0.7060000    
 C    7.512100     -0.7625000     -0.7008000    
 H   -1.150300      -3.582000     -0.2722000    
 H    1.151600      -3.581900      0.2669000    
 H   -3.252400     -0.6261000     -0.7488000    
 H    3.252600     -0.6257000      0.7453000    
 H   -2.955600      -3.335800      -1.598800    
 H   -3.393200      -3.298100      0.1344000    
 H    2.954400      -3.335400       1.597300    
 H    3.394700      -3.297600     -0.1353000    
 H   -1.200000       5.722000     -0.2821000    
 H    1.188300       5.727700      0.2822000    
 H   -5.371500      -3.448300      -1.330800    
 H   -4.922300      -1.912600      -2.115500    
 H    5.370800      -3.447600       1.332900    
 H    4.920200      -1.911800       2.116900    
 H   -3.068200       2.760300     -0.7280000    
 H    2.951100       4.577900      0.6993000    
 H   -6.942400     -0.9129000      -1.363900    
 H   -7.388700      -2.467000     -0.5997000    
 H    7.388800      -2.466000      0.6048000    
 H    6.941200     -0.9119000       1.368300    
 H   -8.559800     -0.5408000      0.4931000    
 H   -6.971300      0.1676000      0.9071000    
 H    8.561400     -0.5396000     -0.4863000    
 H    6.973300      0.1685000     -0.9027000    
 H   -7.853300      -1.063100       2.596000    
 H    7.858100      -1.061900      -2.590200    


%chk=000072750-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072750

0 1
O -2.512050 0.811238 -0.542787
O 3.011009 0.436751 -0.248452
O -2.417479 3.273019 -0.709045
O 3.180674 3.037759 -0.332151
O -5.495342 -1.415845 0.092386
O 5.582058 -1.814398 -0.178189
O -7.389163 -0.520281 2.011408
O 5.570031 1.367110 0.220412
N -2.729621 -1.742570 -0.381847
N 2.883358 -2.066492 0.027644
C -0.555403 -0.601760 -0.321548
C 0.885348 -0.680792 -0.230378
C -1.362409 -1.800793 -0.264740
C 1.522459 -1.971528 -0.064450
C -0.380316 1.913215 -0.497157
C 1.054248 1.848057 -0.406666
C -1.186862 0.696315 -0.460313
C 1.711024 0.532936 -0.291384
C -0.692654 -3.063659 -0.086411
C 0.687567 -3.144185 0.010265
C -1.050086 3.180498 -0.620292
C 1.789660 3.070330 -0.433433
C -3.631612 -2.891434 -0.307100
C 3.703605 -3.253842 0.249064
C -0.286335 4.374644 -0.650451
C 1.109686 4.313583 -0.557274
C -5.026073 -2.485728 -0.790511
C 5.060376 -2.775156 0.797122
C -6.752736 -0.788775 -0.357777
C 6.620261 -0.902264 0.350411
C -7.144656 0.187163 0.751591
C 6.062880 0.325228 1.101521
H -1.283667 -3.981658 -0.020683
H 1.158101 -4.124709 0.132964
H -3.121391 -0.775919 -0.416239
H 3.380660 -1.159207 -0.138160
H -3.271980 -3.719631 -0.950348
H -3.703757 -3.280459 0.731134
H 3.240008 -3.944864 0.980492
H 3.866463 -3.813461 -0.695951
H -0.812582 5.328053 -0.745489
H 1.692793 5.243536 -0.579263
H -5.712746 -3.358229 -0.747144
H -4.978513 -2.120404 -1.839380
H 5.754664 -3.634902 0.910897
H 4.912303 -2.298119 1.789311
H -2.767529 2.281413 -0.659237
H 3.565270 3.950993 -0.331498
H -6.594864 -0.262478 -1.323727
H -7.535416 -1.566844 -0.484325
H 7.161939 -0.548919 -0.543175
H 7.320913 -1.471382 1.002038
H -8.091839 0.692634 0.500224
H -6.347329 0.950147 0.869031
H 6.903038 0.775557 1.667309
H 5.294434 0.005535 1.841328
H -6.583442 -1.071932 2.188237
H 4.610321 1.214503 -0.027713


