%chk=000175012.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000175012

0 1
 O    1.455400     -0.5181000       1.987200    
 O    1.295000       2.585900      -1.431600    
 N    1.047900       1.130200      0.3827000    
 N   -1.231700      0.6235000      6.5300003E-02
 N   -3.540500     -6.9600001E-02 -0.2093000    
 N   -5.785800     -0.8471000     -0.4088000    
 N   -8.004300      -1.694600     -0.6332000    
 C    3.169700      0.1583000      0.4118000    
 C    3.632600      -1.257100      0.1127000    
 C    3.025000       1.016200     -0.8423000    
 C    4.993900      -1.321300     -0.6015000    
 C    1.797200      0.1786000       1.041200    
 C    1.696700       1.701200     -0.6887000    
 C  -0.3004000       1.479800      0.7869000    
 C    5.347300      -2.777000     -0.9157000    
 C    6.114200     -0.6836000      0.2213000    
 C   -2.627300      0.8724000      0.4393000    
 C   -4.915500      0.1257000      0.2500000    
 C   -7.169200     -0.7034000      3.2800000E-02
 H    3.842500      0.6501000       1.124500    
 H    3.685400      -1.826200       1.050600    
 H    2.877300      -1.767200     -0.5007000    
 H    3.825100       1.758600     -0.9140000    
 H    2.990900      0.4263000      -1.764000    
 H    4.933400     -0.7916000      -1.559400    
 H  -0.4800000       2.531400      0.5394000    
 H  -0.3951000       1.337400       1.869000    
 H    4.574600      -3.239200      -1.539100    
 H    6.295300      -2.839200      -1.460800    
 H    5.444000      -3.369600      3.9999999E-04
 H    6.176500      -1.129200       1.219900    
 H    5.963900      0.3941000      0.3355000    
 H    7.083400     -0.8221000     -0.2701000    
 H   -1.008800     -0.3508000      0.2665000    
 H   -2.724900      0.7742000       1.527500    
 H   -2.898200       1.897900      0.1612000    
 H   -3.499100      6.5399997E-02  -1.218600    
 H   -4.962200     -2.2000000E-02   1.335300    
 H   -5.247500       1.145000      1.8700000E-02
 H   -5.739800     -0.7070000      -1.417300    
 H   -7.246200     -0.8545000       1.114800    
 H   -7.551900      0.2964000     -0.1996000    
 H   -7.931500      -1.569700      -1.642000    
 H   -7.637500      -2.625000     -0.4373000    


%chk=000175012-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000175012

0 1
O 1.423939 0.293453 2.585422
O -0.202227 2.849485 -0.984059
N 0.487064 1.767449 1.000022
N -1.616185 2.109008 2.329060
N -2.734868 1.387094 0.193772
N -3.358607 -0.667340 -0.897066
N -1.470199 -2.099853 -1.597884
C 1.979836 0.095874 0.144811
C 1.853627 -1.446639 0.087613
C 1.320940 0.859679 -1.034670
C 2.683553 -2.112457 -1.042518
C 1.301323 0.678728 1.395755
C 0.453742 1.950262 -0.397644
C -0.298641 2.592237 1.987585
C 2.269788 -3.597647 -1.175200
C 4.208110 -1.984410 -0.809843
C -2.721139 2.276005 1.366991
C -3.789055 0.379401 0.047567
C -2.242988 -1.546900 -0.475653
H 3.052704 0.362875 0.222084
H 2.167255 -1.861140 1.066344
H 0.788412 -1.714740 -0.058944
H 2.038354 1.318466 -1.735062
H 0.664112 0.196078 -1.627185
H 2.434291 -1.607667 -2.000973
H -0.380434 3.598081 1.540433
H 0.328212 2.629801 2.894128
H 1.186612 -3.680046 -1.380993
H 2.823761 -4.096917 -1.992209
H 2.483357 -4.147087 -0.237626
H 4.497479 -2.476345 0.138740
H 4.541366 -0.930622 -0.759023
H 4.772556 -2.469273 -1.627962
H -1.618485 1.223700 2.845396
H -3.661005 2.138769 1.936092
H -2.687296 3.330339 1.032013
H -2.412959 1.799529 -0.686783
H -4.009358 -0.004996 1.074533
H -4.750655 0.780780 -0.355200
H -4.142420 -1.158839 -1.342522
H -1.590706 -0.909349 0.147646
H -2.569238 -2.407522 0.151335
H -1.870816 -2.944588 -2.018298
H -1.263313 -1.389216 -2.309522


