%chk=000151289.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151289

0 1
 O   -2.265300       2.637400     -0.7093000    
 N  -0.9408000       1.523400      0.8349000    
 N   -1.452700     -0.8262000       1.317100    
 N    1.536800      -1.184700      0.6754000    
 C  -0.4637000      0.2421000       1.398000    
 C   0.8791000      8.3999997E-03  0.7649000    
 C    1.685500      0.9904000      0.2156000    
 C  -1.1100000E-02   2.658200      0.9930000    
 C    1.253000       2.421800      0.1374000    
 C    2.876900      0.3611000     -0.2387000    
 C   -1.952400       1.606600     -0.1176000    
 C   -2.403500     -0.8204000      0.3098000    
 C    2.758100      -1.000100      6.2500000E-02
 C   -2.668800      0.3468000     -0.4253000    
 C   -1.327400      -1.955200       2.230900    
 C    4.047500      0.8129000     -0.8806000    
 C   -3.162700      -1.962000     -1.7100001E-02
 C    3.758400      -1.929400     -0.2452000    
 C   -3.633300      0.3646000      -1.447700    
 C    5.054600     -0.1069000      -1.193900    
 C    4.910300      -1.456500     -0.8797000    
 C   -4.122500      -1.948100      -1.033400    
 C   -4.356000     -0.7841000      -1.750900    
 H  -0.2860000      0.4512000       2.462200    
 H   0.2478000       2.731100       2.056000    
 H  -0.4913000       3.597100      0.6989000    
 H    2.054600       3.092700      0.4636000    
 H    1.028200       2.654500     -0.9109000    
 H    1.189100      -2.073200       1.007800    
 H   -2.283700      -2.170400       2.720100    
 H  -0.6043000      -1.746300       3.027300    
 H  -0.9819000      -2.851000       1.703800    
 H    4.174300       1.862100      -1.131700    
 H   -3.016000      -2.901700      0.5107000    
 H    3.647300      -2.981100     -2.4000001E-03
 H   -3.837300       1.267800      -2.016900    
 H    5.959200      0.2372000      -1.688100    
 H    5.705100      -2.153800      -1.132200    
 H   -4.684000      -2.849700      -1.260300    
 H   -5.100600     -0.7685000      -2.540900    


%chk=000151289-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000151289

0 1
O -2.053908 2.682818 -0.791246
N -0.988637 1.558518 0.949021
N -1.478592 -0.803963 1.398394
N 1.495981 -1.230844 0.666799
C -0.477976 0.270508 1.487461
C 0.850610 0.009972 0.784274
C 1.646993 1.013907 0.233141
C -0.025014 2.676717 1.112502
C 1.225350 2.466434 0.205690
C 2.842076 0.368451 -0.275523
C -1.861194 1.600178 -0.150202
C -2.369380 -0.846369 0.318305
C 2.718216 -1.041516 0.004829
C -2.561622 0.328019 -0.476855
C -1.440280 -1.877406 2.394846
C 4.005623 0.836856 -0.941805
C -3.124797 -2.014235 0.012650
C 3.709776 -1.974869 -0.366640
C -3.466688 0.306731 -1.562058
C 4.999609 -0.090002 -1.311406
C 4.853043 -1.480506 -1.028038
C -4.028476 -2.009749 -1.069501
C -4.202434 -0.854462 -1.869900
H -0.284114 0.428055 2.570667
H 0.272090 2.713859 2.177289
H -0.546095 3.609232 0.847632
H 2.041668 3.128441 0.554911
H 0.979813 2.778122 -0.828166
H 1.090544 -2.130527 0.913833
H -2.460543 -2.116542 2.749418
H -0.846706 -1.546535 3.263943
H -0.991500 -2.820641 2.011897
H 4.126643 1.901809 -1.169819
H -2.998375 -2.926633 0.603156
H 3.603388 -3.044421 -0.152947
H -3.581135 1.231580 -2.137179
H 5.901506 0.257050 -1.827677
H 5.643447 -2.176600 -1.330192
H -4.595741 -2.920552 -1.293589
H -4.902670 -0.862784 -2.710819


