%chk=000021187.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021187

0 1
 O    1.762500       3.076400      -1.045300    
 O    1.849100       3.106100       1.225800    
 N  -0.4111000      -1.225700     -6.3000001E-02
 N   -4.675600      0.7641000     -0.5557000    
 C    1.644700      2.9100001E-02  1.6500000E-02
 C   0.9348000      -1.187300     -6.2399998E-02
 C   0.9085000       1.218800      9.5700003E-02
 C   -1.084300     -5.5000000E-02  1.4700000E-02
 C    3.050000      3.2000002E-02  1.4800000E-02
 C    3.756700      -1.164500     -6.4700000E-02
 C  -0.4785000       1.182400      9.5299996E-02
 C    1.666800      -2.368900     -0.1409000    
 C    3.063900      -2.366300     -0.1426000    
 C   -2.522700     -0.1804000      8.8999998E-03
 C    5.247500      -1.157400     -6.6500001E-02
 C    1.540300       2.532200      0.1802000    
 C   -3.146600      -1.307300      0.5327000    
 C   -3.325400      0.8182000     -0.5190000    
 C   -4.534000      -1.399800      0.5129000    
 C   -5.246400     -0.3465000     -3.7500001E-02
 H    3.608500      0.9634000      7.7399999E-02
 H   -1.040700       2.107000      0.1800000    
 H    1.147400      -3.323500     -0.2023000    
 H    3.595400      -3.312300     -0.2036000    
 H    5.624300      -1.115500      0.9603000    
 H    5.650500      -2.054400     -0.5486000    
 H    5.634100     -0.2950000     -0.6201000    
 H   -2.580500      -2.124800      0.9719000    
 H   -2.923300       1.719700     -0.9707000    
 H   -5.042000      -2.267700      0.9177000    
 H   -6.330400     -0.3694000     -7.6200001E-02
 H    2.188300       3.957900     -0.9817000    


%chk=000021187-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021187

0 1
O 0.703728 3.649138 -0.488745
O 2.876322 2.865882 -0.424555
N -0.373164 -1.204547 0.121065
N -4.776595 0.914370 0.015409
C 1.773887 0.062927 -0.053149
C 1.006516 -1.163246 0.103665
C 0.999853 1.278353 -0.199262
C -1.070565 -0.048420 -0.014563
C 3.203563 -0.017818 -0.054469
C 3.865964 -1.245293 0.090696
C -0.400352 1.207025 -0.179375
C 1.701341 -2.407933 0.251556
C 3.092443 -2.447131 0.245013
C -2.557352 -0.152726 0.012013
C 5.380119 -1.324848 0.087660
C 1.647316 2.613196 -0.374889
C -3.178516 -1.431005 0.062713
C -3.413964 0.983413 -0.005722
C -4.583031 -1.520614 0.086193
C -5.343634 -0.327353 0.058284
H 3.778750 0.903261 -0.172593
H -0.967551 2.130539 -0.299335
H 1.094729 -3.310824 0.368516
H 3.614510 -3.404886 0.359079
H 5.758735 -1.750201 1.036619
H 5.742782 -1.981357 -0.726044
H 5.839404 -0.331707 -0.046725
H -2.539110 -2.318037 0.083962
H -3.010909 2.001834 -0.030596
H -5.085897 -2.492122 0.124027
H -6.439186 -0.352501 0.070869
H 1.191663 4.508230 -0.603318


