%chk=000015555.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015555

0 1
 O   -5.818200     -0.6466000      -1.158600    
 O   -2.690900      0.7633000       2.395900    
 O    1.493300       2.335200     -0.7188000    
 O    1.238200      -2.348200      0.2508000    
 O    2.664300     -0.1748000     -0.7062000    
 O    4.878200     -0.2122000     -0.3042000    
 O    3.452100      0.2289000       1.452100    
 N   -3.629400      0.3757000      0.2913000    
 C   -5.001200      0.6275000      0.7302000    
 C   -3.497700      6.7400001E-02  -1.137900    
 C   -5.922700     -0.4880000      0.2589000    
 C   -4.490300      -1.018100      -1.536500    
 C   -2.576400      0.5048000       1.198500    
 C   -1.206400      0.3271000      0.6990000    
 C  -0.6248000     -0.9381000      0.7088000    
 C  -0.4955000       1.424500      0.2204000    
 C   0.8061000       1.255500     -0.2520000    
 C   0.6768000      -1.106900      0.2365000    
 C    1.392200     -1.0100000E-02 -0.2440000    
 C    1.368000       2.631900      -2.108200    
 C    1.054300      -3.156100     -0.9101000    
 C    3.656900     -2.6200000E-02  0.2721000    
 C    6.001000     -9.1899998E-02  0.5752000    
 C    7.272100     -0.3246000     -0.2134000    
 H   -5.054300      0.7353000       1.817700    
 H   -5.300900       1.580800      0.2790000    
 H   -3.723100      0.9972000      -1.673600    
 H   -2.483400     -0.2368000      -1.402800    
 H   -6.962700     -0.2420000      0.4942000    
 H   -5.683000      -1.439600      0.7483000    
 H   -4.237800      -1.978200      -1.070700    
 H   -4.476400      -1.158900      -2.621800    
 H   -1.180100      -1.794700       1.083300    
 H  -0.9499000       2.412400      0.2136000    
 H   0.3263000       2.854500      -2.360200    
 H    1.731400       1.796500      -2.714900    
 H    1.977000       3.513500      -2.326500    
 H  -9.8999999E-03  -3.349600      -1.077900    
 H    1.491700      -2.672400      -1.789300    
 H    1.562200      -4.110600     -0.7473000    
 H    5.919900     -0.8367000       1.374800    
 H    6.015700      0.9123000       1.013200    
 H    7.358300      0.4016000      -1.028400    
 H    7.264000      -1.318500     -0.6729000    
 H    8.152500     -0.2399000      0.4298000    


%chk=000015555-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000015555

0 1
O -6.233302 0.230228 -1.113065
O -3.019120 -0.731898 2.277875
O 1.134662 2.002284 -0.971087
O 1.382671 -2.709606 0.521318
O 2.660588 -0.416588 -0.688612
O 4.826218 -0.076936 -0.321349
O 3.332852 0.429882 1.423439
N -3.797421 0.447597 0.426096
C -5.119416 0.643754 1.068331
C -3.795060 0.746742 -1.023828
C -6.207324 -0.143354 0.315245
C -4.925723 -0.042125 -1.723984
C -2.791188 -0.207661 1.139463
C -1.399774 -0.251958 0.551503
C -0.660061 -1.446373 0.709230
C -0.794795 0.880788 -0.046887
C 0.548172 0.824323 -0.475152
C 0.678840 -1.521931 0.270792
C 1.286814 -0.373533 -0.300532
C 1.703760 1.933037 -2.337783
C 2.052257 -3.356221 -0.631605
C 3.591658 0.030304 0.277993
C 5.979474 0.349514 0.541257
C 7.240372 0.130164 -0.284512
H -5.040812 0.302367 2.113784
H -5.363431 1.723990 1.047181
H -3.960281 1.832298 -1.175394
H -2.824975 0.472912 -1.466470
H -7.211016 0.099061 0.700197
H -6.024196 -1.234559 0.415036
H -4.704838 -1.131466 -1.676592
H -5.020209 0.267858 -2.778147
H -1.107300 -2.312827 1.203272
H -1.326360 1.831461 -0.148675
H 0.901370 1.731343 -3.073197
H 2.486623 1.158937 -2.409846
H 2.133719 2.929758 -2.516734
H 1.301293 -3.650564 -1.389394
H 2.808034 -2.693067 -1.084867
H 2.530497 -4.253295 -0.211211
H 5.961593 -0.258471 1.463356
H 5.827316 1.408691 0.815703
H 7.216848 0.730059 -1.210001
H 7.353424 -0.932236 -0.558918
H 8.125045 0.433516 0.304171


