%chk=000008540.chk
%nprocshared=24
%mem=100GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008540

0 1
 O   8.2999999E-03   2.492600     -0.2254000    
 O   -3.975800       1.731100      3.9299998E-02
 O   -2.336800       3.188800     -0.1240000    
 O  -0.9804000      -3.692600      0.1300000    
 O   -3.055000      -2.967000      0.2152000    
 N   -2.757400       2.011200     -4.3400001E-02
 N   -1.820400      -2.761400      0.1341000    
 C    1.957600      0.4138000     -0.2334000    
 C    2.686600     -0.7087000     -0.9925000    
 C    2.591000      0.6449000       1.149800    
 C    4.185600     -0.4316000      -1.094400    
 C    4.090400      0.9163000       1.039000    
 C    4.809000     -0.1941000      0.2780000    
 C   0.4657000      0.1523000     -0.1355000    
 C  -0.4445000       1.208200     -0.1352000    
 C   1.1600000E-02  -1.162700     -4.5899998E-02
 C   -1.812100      0.9483000     -4.5100000E-02
 C   -1.355800      -1.422500      4.4599999E-02
 C   -2.267800     -0.3670000      4.4900000E-02
 H    2.117100       1.311900     -0.8455000    
 H    2.268500     -0.8294000      -1.999400    
 H    2.597000      -1.674400     -0.4840000    
 H    2.429300     -0.2350000       1.786500    
 H    2.110400       1.487500       1.660700    
 H    4.352000      0.4479000      -1.728600    
 H    4.684600      -1.275700      -1.584100    
 H    4.521600       1.013600       2.041700    
 H    4.251000       1.873400      0.5276000    
 H    4.769200      -1.121500      0.8624000    
 H    5.867500      6.4599998E-02  0.1617000    
 H   0.7052000      -1.993600     -8.8000000E-03
 H   -3.333300     -0.5727000      0.1150000    
 H   0.9177000       2.562300      0.1029000    


%chk=000008540-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000008540

0 1
O 0.041976 2.493229 -0.053400
O -3.843871 1.874478 0.837154
O -2.549314 3.153756 -0.541251
O -1.136349 -3.771336 -0.123000
O -3.256109 -2.954550 0.104898
N -2.786287 2.077898 0.121155
N -1.981109 -2.798006 -0.018427
C 1.988724 0.330163 -0.283599
C 2.796667 -0.823825 -0.931583
C 2.583808 0.658205 1.126088
C 4.293844 -0.453249 -1.046074
C 4.082740 1.026657 1.027330
C 4.894790 -0.092243 0.333454
C 0.484869 0.073436 -0.198949
C -0.412846 1.187438 -0.088104
C -0.057323 -1.222815 -0.185368
C -1.813861 0.959446 0.035691
C -1.448619 -1.418447 -0.041694
C -2.340221 -0.342008 0.082518
H 2.166154 1.219123 -0.938083
H 2.380299 -1.068635 -1.927486
H 2.706369 -1.734757 -0.305818
H 2.461824 -0.238155 1.766367
H 2.018807 1.472156 1.622877
H 4.408788 0.408592 -1.735780
H 4.851321 -1.296077 -1.496351
H 4.485168 1.220297 2.039558
H 4.194644 1.970702 0.453692
H 4.896902 -0.994511 0.978765
H 5.950056 0.219882 0.218898
H 0.580888 -2.103825 -0.281725
H -3.413113 -0.506389 0.207746
H 1.027983 2.532169 -0.151299


