%chk=000177584.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177584

0 1
 O   0.4398000       1.523300     -0.3488000    
 O    6.094700      -1.077700      0.1237000    
 O   -2.173700      -1.823000       1.010800    
 O    1.729700       2.284900       1.409900    
 N   -1.610600     -0.4500000     -0.7710000    
 C   0.5948000      0.1801000      0.1094000    
 C  -0.2007000     -0.7678000     -0.7884000    
 C    2.067900     -0.1570000      0.1131000    
 C    2.762000     -0.1736000      -1.085300    
 C    2.694400     -0.4424000       1.314600    
 C    4.121700     -0.4846000      -1.082000    
 C    4.054200     -0.7533000       1.318100    
 C    4.767900     -0.7745000      0.1198000    
 C   -2.517900      -1.005000      0.1391000    
 C   -3.909600     -0.6032000      1.2300000E-02
 C    1.064000       2.477500      0.4015000    
 C   -4.924500      -1.458700      0.4413000    
 C   -4.230000      0.6381000     -0.5377000    
 C   0.8164000       3.829900     -0.1951000    
 C   -6.259500      -1.073100      0.3200000    
 C   -5.565100       1.023500     -0.6588000    
 C   -6.579800      0.1680000     -0.2299000    
 C    6.763800      -1.081400      -1.136600    
 H   0.1793000      0.1205000       1.125000    
 H  -6.3000001E-02  -1.809300     -0.4764000    
 H   0.1030000     -0.6817000      -1.837100    
 H   -1.938400      0.1720000      -1.502000    
 H    2.278700      6.2700003E-02  -2.028600    
 H    2.149300     -0.4339000       2.254100    
 H    4.616100     -0.4798000      -2.047500    
 H    4.551900     -0.9790000       2.257300    
 H   -4.696600      -2.431700      0.8687000    
 H   -3.471900       1.348300     -0.8544000    
 H    1.314000       4.591000      0.4127000    
 H    1.227100       3.868700      -1.207100    
 H  -0.2561000       4.039400     -0.2059000    
 H   -7.049800      -1.739400      0.6533000    
 H   -5.814900       1.992900      -1.080100    
 H   -7.619100      0.4688000     -0.3228000    
 H    7.809700      -1.343600     -0.9465000    
 H    6.358400      -1.848500      -1.805100    
 H    6.761800     -8.7200001E-02  -1.596000    


%chk=000177584-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177584

0 1
O 0.455817 1.574819 -0.506361
O 6.281689 -1.180083 0.168786
O -2.343257 -2.417680 0.220620
O 1.027784 2.678486 1.472459
N -1.597615 -0.352458 -0.546997
C 0.706720 0.237754 0.174537
C -0.188625 -0.747450 -0.595511
C 2.179488 -0.110870 0.130556
C 2.866763 -0.252827 -1.099166
C 2.898235 -0.318040 1.336961
C 4.233605 -0.603064 -1.138014
C 4.257021 -0.675335 1.317640
C 4.929622 -0.822370 0.078115
C -2.594781 -1.216080 -0.115412
C -3.997367 -0.660225 -0.083378
C 0.708494 2.721339 0.264652
C -5.064983 -1.593775 -0.070633
C -4.290788 0.728277 -0.037822
C 0.564679 3.971788 -0.576563
C -6.402835 -1.149694 -0.038967
C -5.630889 1.172694 -0.000374
C -6.690181 0.235755 -0.008171
C 7.025859 -1.352560 -1.081684
H 0.362283 0.336383 1.219164
H -0.112524 -1.751637 -0.144043
H 0.158042 -0.822017 -1.644531
H -1.829577 0.580818 -0.888351
H 2.339226 -0.068961 -2.042243
H 2.388871 -0.186765 2.298075
H 4.738341 -0.701169 -2.103576
H 4.819354 -0.837296 2.241855
H -4.815139 -2.659709 -0.077989
H -3.486019 1.472213 0.010234
H 0.298639 4.823930 0.067106
H 1.534658 4.193170 -1.058902
H -0.184703 3.837442 -1.372199
H -7.220197 -1.879052 -0.034999
H -5.848281 2.245496 0.045797
H -7.729258 0.582326 0.020064
H 8.042008 -1.637847 -0.772830
H 6.585718 -2.155528 -1.704374
H 7.063507 -0.409995 -1.661932


