%chk=000083984.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083984

0 1
 O    4.028600      0.3361000      0.3029000    
 O    3.356800      -1.157200      -1.267400    
 N   -3.594700       1.476200      -1.150500    
 C    1.546300      0.9533000       1.239100    
 C    1.722900     -6.7000002E-02  0.1390000    
 C  -0.6998000     -0.5951000     -0.1555000    
 C   0.7252000     -0.7312000     -0.4761000    
 C   -1.459200      0.3702000     -0.8034000    
 C   -1.271200      -1.434000      0.7923000    
 C    1.391300       2.367600      0.6958000    
 C   -2.814200      0.4991000     -0.4983000    
 C   -2.626100      -1.305000       1.097600    
 C   -3.397700     -0.3386000      0.4523000    
 C    3.091800     -0.3743000     -0.3676000    
 H    2.380900      0.9148000       1.948300    
 H   0.6615000      0.7125000       1.840600    
 H   0.9217000      -1.446000      -1.271900    
 H   -1.006000       1.022100      -1.547300    
 H  -0.6815000      -2.191300       1.302400    
 H   0.5189000       2.457700      4.1900001E-02
 H    2.275500       2.672600      0.1263000    
 H    1.263900       3.074600       1.522000    
 H   -3.080400      -1.957100       1.837900    
 H   -4.452400     -0.2481000      0.6990000    
 H   -4.577000       1.569900     -0.9290000    
 H   -3.172300       2.084700      -1.839000    
 H    4.935100      0.1455000     -2.0000000E-02


%chk=000083984-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000083984

0 1
O 4.069400 0.519448 0.579546
O 3.455204 -1.596105 -0.138835
N -3.555102 1.755427 -0.156337
C 1.520092 1.500821 0.850213
C 1.707789 0.069722 0.376411
C -0.747291 -0.720319 0.086977
C 0.718319 -0.844713 0.081976
C -1.453848 0.507820 -0.035839
C -1.494513 -1.933399 0.192525
C 1.673953 2.547301 -0.287446
C -2.875176 0.543082 -0.024572
C -2.902861 -1.899457 0.217030
C -3.598517 -0.678399 0.114368
C 3.099188 -0.448275 0.236598
H 2.280792 1.720142 1.620066
H 0.531620 1.602734 1.331887
H 1.086138 -1.850178 -0.173668
H -0.908289 1.442982 -0.190296
H -0.961960 -2.887768 0.268479
H 0.952909 2.369997 -1.106804
H 2.690325 2.499225 -0.714689
H 1.515245 3.570342 0.100780
H -3.468173 -2.833400 0.310522
H -4.695288 -0.663993 0.125903
H -4.570017 1.783849 -0.169998
H -3.048778 2.630579 -0.251448
H 4.966736 0.104535 0.468051


