%chk=000174688.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000174688

0 1
 O   -5.081500      -2.154900      0.1806000    
 O   -2.511400       3.521000      -1.004500    
 N   -2.121600      4.6000000E-02  0.1710000    
 N   0.1711000     -0.4876000      0.3886000    
 N   0.2796000      0.1731000       1.553200    
 N    1.553000      0.5240000       1.697100    
 C   -1.108000     -0.9946000     -4.2199999E-02
 C   -3.439400     -0.4624000     -0.2193000    
 C   -1.826800       1.268300     -0.5828000    
 C    1.371400     -0.5831000     -0.2541000    
 C    2.243800      7.2899997E-02  0.6036000    
 C   -3.792300      -1.707500      0.5785000    
 C   -2.845000       2.352300     -0.2672000    
 C    3.600100      0.1754000      0.2619000    
 C    1.764100      -1.159600      -1.460200    
 C    4.022400     -0.3957000     -0.9457000    
 C    3.119700      -1.050500      -1.789400    
 C    4.600700      0.8632000       1.131100    
 H   -1.045600      -1.299400      -1.092200    
 H   -1.256400      -1.878600      0.5839000    
 H   -3.494000     -0.6808000      -1.294400    
 H   -4.238900      0.2526000     -6.6000000E-03
 H   -1.809300       1.075200      -1.664300    
 H  -0.8405000       1.682000     -0.3437000    
 H   -3.805700      -1.516000       1.656700    
 H   -3.129600      -2.551800      0.3801000    
 H   -2.836400       2.609000      0.7970000    
 H   -3.867800       2.107100     -0.5584000    
 H    1.067400      -1.668700      -2.115700    
 H    5.067700     -0.3345000      -1.240800    
 H    3.477700      -1.484100      -2.720100    
 H    5.383900      0.1614000       1.435900    
 H    5.061100       1.697700      0.5921000    
 H    4.138400       1.264600       2.038500    
 H   -5.717900      -1.453400      0.4009000    
 H   -2.549700       3.294400      -1.949500    


%chk=000174688-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000174688

0 1
O -4.071819 -0.694951 2.465319
O -1.853068 2.853382 -2.224178
N -2.317278 -0.723012 -0.941795
N 0.020231 -1.281295 -0.209338
N 0.144881 -1.820763 1.104045
N 1.295406 -1.380894 1.627609
C -1.192637 -1.615634 -1.025470
C -3.331539 -0.933779 0.103230
C -2.389018 0.458961 -1.808189
C 1.123116 -0.491371 -0.504331
C 1.936935 -0.560060 0.674381
C -2.982678 -0.401092 1.520596
C -1.857923 1.789526 -1.206731
C 3.180543 0.121735 0.772029
C 1.513752 0.261555 -1.637432
C 3.559086 0.866714 -0.365248
C 2.746047 0.934360 -1.538124
C 4.025577 0.038021 2.026358
H -0.840526 -1.688394 -2.071872
H -1.489885 -2.619230 -0.672844
H -3.540233 -2.018238 0.201780
H -4.274442 -0.455411 -0.238133
H -3.445814 0.611643 -2.120278
H -1.812537 0.261790 -2.734222
H -2.758648 0.686759 1.487909
H -2.106569 -0.930465 1.926116
H -0.804527 1.689399 -0.902487
H -2.455602 2.086673 -0.319255
H 0.901661 0.332611 -2.541565
H 4.508348 1.414983 -0.348788
H 3.092767 1.534930 -2.386377
H 5.027449 -0.373584 1.803878
H 4.174796 1.038930 2.472364
H 3.544424 -0.607270 2.778124
H -4.879172 -0.183131 2.203788
H -2.786807 3.073601 -2.471269


