%chk=000171122.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171122

0 1
 O  -1.2900000E-02  -2.679200      -1.890000    
 O   -3.134300      -1.212000     -0.8943000    
 O    3.147100      -1.242800     -0.8147000    
 O   1.2000000E-02 -0.5071000      -2.580900    
 O    1.036200       3.687200     -0.8301000    
 O  -0.8488000       4.050200      0.2980000    
 N   1.1800000E-02   1.836600      0.1778000    
 C  -1.0600000E-02  -1.026300     -0.2171000    
 C   -1.242400     -0.2357000      8.4799998E-02
 C    1.227400     -0.2582000      0.1001000    
 C   -1.207900       1.103600      0.2800000    
 C    1.211600       1.079200      0.2974000    
 C   -2.482500      -1.035700      0.1309000    
 C    2.460300      -1.064500      0.1876000    
 C  -1.4000000E-03  -1.339200      -1.686000    
 C   -2.459600       1.878400      0.6356000    
 C    2.457600       1.800800      0.7731000    
 C   -2.869900      -1.598700       1.482900    
 C    2.799600      -1.630400       1.551600    
 C   5.9000002E-03   3.241100     -5.1700000E-02
 C   -4.169000      -2.384200       1.431400    
 C    4.069800      -2.463100       1.533400    
 H  -2.2399999E-02  -1.952500      0.3712000    
 H   -2.309000       2.452600       1.555900    
 H   -3.326900       1.237800      0.8184000    
 H   -2.744100       2.550300     -0.1806000    
 H    2.203300       2.549500       1.531600    
 H    2.953900       2.300600     -6.4599998E-02
 H    3.198200       1.144500       1.234900    
 H   -2.066100      -2.257500       1.828700    
 H   -2.974800     -0.7744000       2.195800    
 H    2.912900     -0.8144000       2.271200    
 H    1.967000      -2.262800       1.879200    
 H   -4.091000      -3.228200      0.7381000    
 H   -4.416500      -2.777200       2.422200    
 H   -4.997500      -1.751000       1.097200    
 H    4.929500      -1.860200       1.222700    
 H    4.276300      -2.865800       2.529700    
 H    3.979700      -3.303100      0.8367000    
 H  -8.2999999E-03  -2.904300      -2.844700    
 H   0.9772000       4.652800     -0.9923000    


%chk=000171122-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000171122

0 1
O 1.041487 -1.817595 -2.260835
O -1.803513 -2.740762 0.661037
O 3.703848 -0.152525 1.026365
O -0.668591 -0.253357 -2.384334
O 0.905645 3.117556 -1.408229
O -1.364984 3.398500 -1.037943
N -0.131515 1.669686 0.061365
C 0.193089 -1.010054 -0.156432
C -1.070763 -0.487481 0.512992
C 1.394808 -0.178758 0.313135
C -1.265871 0.878030 0.504521
C 1.204123 1.185537 0.371595
C -1.966999 -1.542485 1.066104
C 2.681493 -0.835233 0.700820
C 0.094667 -0.954395 -1.690626
C -2.498774 1.636158 0.923805
C 2.199705 2.205254 0.869638
C -3.009728 -1.292521 2.160528
C 2.744634 -2.365439 0.681541
C -0.303689 2.781371 -0.791246
C -4.457196 -1.496306 1.638466
C 4.121563 -2.914910 1.087852
H 0.312341 -2.072460 0.100428
H -2.309429 2.214543 1.849008
H -3.346222 0.960711 1.083904
H -2.775290 2.366260 0.146387
H 1.715093 3.176886 1.053341
H 3.020276 2.347115 0.147095
H 2.674671 1.835289 1.793889
H -2.812351 -2.059550 2.933680
H -2.889738 -0.307658 2.639464
H 1.955396 -2.765375 1.352811
H 2.468129 -2.709115 -0.335963
H -4.549478 -2.492885 1.174209
H -5.180744 -1.428447 2.469829
H -4.735027 -0.741701 0.879797
H 4.391643 -2.597966 2.109804
H 4.122236 -4.018754 1.048091
H 4.909726 -2.536899 0.414446
H 0.989408 -1.755947 -3.253134
H 0.737319 3.892384 -2.006107


