%chk=000127536.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127536

0 1
 O    1.188800      -2.381300      0.6894000    
 O   -1.188900       2.381600      0.6918000    
 O   -2.007700      -4.557500      -1.032600    
 O    2.008500       4.557500      -1.033400    
 O    4.856000     -0.8035000     -1.7000000E-03
 O   -4.856100      0.8033000     -1.7000000E-03
 O    3.044200      -1.360600      -1.297300    
 O   -3.044300       1.360000      -1.297700    
 N   -1.494700      -2.360600      0.6922000    
 N    1.494600       2.360900      0.6915000    
 N    2.816500     -0.1797000      0.6916000    
 N   -2.816600      0.1799000      0.6918000    
 C  -0.8381000      -1.156600      0.6923000    
 C   0.8380000       1.156800      0.6915000    
 C    1.458600     -3.2400001E-02  0.6918000    
 C   -1.458700      3.2699998E-02  0.6921000    
 C   0.6424000      -1.279600      0.6918000    
 C  -0.6425000       1.280000      0.6914000    
 C   -2.769500      -2.559800      6.1900001E-02
 C    2.769800       2.560000      6.1900001E-02
 C   -3.010600      -4.042400     -0.1660000    
 C    3.011000       4.042600     -0.1662000    
 C    3.521800     -0.8314000     -0.2985000    
 C   -3.521900      0.8312000     -0.2985000    
 C    5.719500      -1.446300     -0.9459000    
 C   -5.719700       1.445700     -0.9464000    
 C    7.150800      -1.323600     -0.4683000    
 C   -7.151000       1.323200     -0.4687000    
 H  -0.9127000      -3.180200      0.8416000    
 H   0.9127000       3.180600      0.8409000    
 H   -3.589500      -2.214900      0.6965000    
 H   -2.806100      -2.050300     -0.9084000    
 H    3.589400       2.215300      0.6972000    
 H    2.806900       2.050300     -0.9082000    
 H    3.354000      0.3922000       1.334700    
 H   -3.354100     -0.3918000       1.335000    
 H   -2.971800      -4.598800      0.7765000    
 H   -3.988000      -4.202700     -0.6320000    
 H    2.971700       4.599200      0.7763000    
 H    3.988600       4.202600     -0.6317000    
 H   -2.197100      -5.503100      -1.157400    
 H    2.198100       5.503000      -1.158300    
 H    5.613100     -0.9645000      -1.924100    
 H    5.446200      -2.504000      -1.029000    
 H   -5.613300      0.9633000      -1.924400    
 H   -5.446400       2.503400      -1.030000    
 H    7.432700     -0.2708000     -0.3624000    
 H    7.268800      -1.784900      0.5178000    
 H    7.839400      -1.805100      -1.168200    
 H   -7.432900      0.2704000     -0.3623000    
 H   -7.269000       1.784900      0.5171000    
 H   -7.839600       1.804400      -1.168800    


%chk=000127536-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000127536

0 1
O 0.999305 -2.538267 0.269869
O -0.999064 2.538812 0.267782
O -2.420877 -4.772709 1.405832
O 2.420335 4.773879 1.404997
O 4.831041 -0.864726 -0.966466
O -4.830746 0.863955 -0.967136
O 3.438783 0.888547 -1.708532
O -3.438896 -0.890584 -1.706950
N -1.602361 -2.274099 0.547932
N 1.602664 2.274952 0.546918
N 2.837851 -0.552549 0.073109
N -2.837430 0.552962 0.072525
C -0.949252 -1.104977 0.341448
C 0.949682 1.105670 0.340876
C 1.456754 -0.195018 0.195617
C -1.456315 0.195548 0.195261
C 0.561033 -1.324724 0.252240
C -0.560607 1.325288 0.251499
C -3.017143 -2.524052 0.843809
C 3.017230 2.525275 0.843504
C -3.121324 -3.591490 1.938367
C 3.120573 3.592782 1.938081
C 3.658709 -0.085775 -0.946185
C -3.658619 0.084760 -0.945843
C 5.816728 -0.495198 -2.021102
C -5.816476 0.493327 -2.021351
C 6.973084 -1.483098 -1.901671
C -6.972796 1.481394 -1.902957
H -0.991639 -3.109734 0.512736
H 0.991739 3.110424 0.511485
H -3.504898 -1.595901 1.179890
H -3.529490 -2.880550 -0.067872
H 3.505056 1.597267 1.179860
H 3.529909 2.881908 -0.067931
H 3.059004 -1.494124 0.420106
H -3.058331 1.495055 0.418354
H -2.643718 -3.233644 2.874252
H -4.191391 -3.812299 2.131609
H 2.642421 3.234971 2.873704
H 4.190486 3.813759 2.131980
H -2.328245 -5.466039 2.104312
H 2.327169 5.467251 2.103366
H 6.136206 0.550151 -1.854891
H 5.316023 -0.548918 -3.004695
H -6.135966 -0.551834 -1.854008
H -5.315790 0.545975 -3.005014
H 7.443746 -1.421685 -0.905358
H 6.622868 -2.517592 -2.058055
H 7.740041 -1.255446 -2.664380
H -7.443417 1.421077 -0.906558
H -6.622559 2.515708 -2.060478
H -7.739789 1.252936 -2.665388


