%chk=000148224.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148224

0 1
 O   0.9321000     -0.4333000      -1.660900    
 O  -0.5047000       3.183800      -1.077100    
 O   0.1956000       2.432600      0.9464000    
 N  -0.4952000     -0.1089000      0.1379000    
 N   0.3995000      -3.082900     -2.4800001E-02
 N    4.571800     -0.5141000     -0.5774000    
 N   -7.208400     -0.9454000      0.5808000    
 N    4.423000       1.025300       1.016300    
 C   -2.637700       1.118700      0.1146000    
 C   -1.214400       1.000700     -0.4329000    
 C   -3.546100     -7.6200001E-02 -0.2014000    
 C   -4.978500      9.9399999E-02  0.3145000    
 C    1.166800      -1.872800      0.2738000    
 C    2.637800      -2.076200     -0.1200000    
 C   0.5379000     -0.7447000     -0.5381000    
 C   -5.863000      -1.120800      4.7400001E-02
 C  -0.4196000       2.247400     -9.5700003E-02
 C    3.486600     -0.8605000      0.1772000    
 C    3.415200      0.1040000       1.154800    
 C    5.101500      0.6239000     -3.5500001E-02
 H   -2.602700       1.255700       1.203900    
 H   -3.099500       2.029200     -0.2893000    
 H   -1.231500      0.8795000      -1.522500    
 H   -3.572000     -0.2315000      -1.287000    
 H   -3.118100     -0.9848000      0.2391000    
 H   -4.946900      0.2942000       1.394100    
 H   -5.423500      0.9858000     -0.1549000    
 H    1.088500      -1.653400       1.345100    
 H  -0.7164000     -0.3911000       1.088500    
 H    2.722000      -2.320300      -1.187500    
 H    3.058200      -2.924400      0.4359000    
 H   -5.924200      -1.304800      -1.031000    
 H   -5.415900      -2.008900      0.5070000    
 H   0.7927000      -3.871300      0.4879000    
 H  -0.5559000      -2.973000      0.3139000    
 H    4.921500      -1.007100      -1.388200    
 H    2.693300      0.1873000       1.954400    
 H   -7.647200     -0.1359000      0.1439000    
 H   -7.779700      -1.751100      0.3298000    
 H    5.974400       1.105800     -0.4521000    
 H  -8.8999998E-03   3.998700     -0.8482000    


%chk=000148224-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000148224

0 1
O 0.301491 -0.246691 -0.910748
O -1.535704 4.113670 0.523571
O -0.543945 3.114780 2.373116
N -0.389109 0.698439 1.090032
N 0.154323 -2.054221 1.972205
N 3.022602 -0.664361 -1.432693
N -6.277298 -1.886897 -1.173198
N 5.251829 -0.834322 -1.094024
C -2.747124 1.339812 0.423120
C -1.231096 1.721008 0.453334
C -3.025311 0.043112 -0.366474
C -4.531725 -0.296343 -0.401416
C 1.133253 -1.228342 1.229895
C 2.014481 -2.169476 0.364399
C 0.331329 -0.226689 0.362091
C -4.828282 -1.597888 -1.174979
C -1.040987 3.021175 1.226863
C 3.178088 -1.519009 -0.331499
C 4.564375 -1.611124 -0.145582
C 4.284996 -0.274938 -1.854055
H -3.113393 1.232749 1.464303
H -3.296584 2.185812 -0.032423
H -0.879818 1.846287 -0.587413
H -2.633613 0.148399 -1.397553
H -2.469534 -0.798798 0.090740
H -4.930838 -0.408146 0.625567
H -5.091078 0.542089 -0.869541
H 1.812769 -0.633353 1.890952
H -0.214686 0.818732 2.093674
H 1.344917 -2.672568 -0.357320
H 2.418543 -2.951747 1.034740
H -4.382127 -1.515533 -2.197200
H -4.312596 -2.438428 -0.671866
H 0.567725 -2.833520 2.490815
H -0.558769 -1.548814 2.503198
H 2.095323 -0.382768 -1.773089
H 5.105199 -2.190197 0.600847
H -6.841135 -1.170879 -1.643303
H -6.521857 -2.830224 -1.489369
H 4.456038 0.395459 -2.692869
H -1.432272 4.942355 1.065857


