%chk=000089022.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089022

0 1
 O   -3.685500     -0.9832000     -0.1744000    
 N   0.8887000      -1.783800      0.1888000    
 N   0.1055000      0.4259000      0.1366000    
 N  -0.7369000       2.613600      7.9099998E-02
 N   -1.420800      -1.421000      5.5000000E-03
 N   -2.252600      0.8290000     -5.0400000E-02
 N    2.920900      8.8699996E-02  -1.801700    
 C    2.272900      -1.362900      0.3002000    
 C    3.155100      -2.611800      0.3670000    
 C    2.434400     -0.5301000       1.575000    
 C  -0.1717000     -0.9017000      0.1079000    
 C    2.634900     -0.5506000     -0.8764000    
 C  -0.9728000       1.221900      5.4000001E-02
 C   0.5728000       3.176200      0.1864000    
 C   -2.400200     -0.5056000     -6.8700001E-02
 C   0.4942000       4.690600      0.1644000    
 C   -3.838700      -2.395200     -0.1935000    
 H   0.6656000      -2.772500      0.1691000    
 H    3.034200      -3.235100     -0.5277000    
 H    4.217100      -2.349800      0.4415000    
 H    2.899900      -3.232700       1.234000    
 H    2.010600      0.4760000       1.519700    
 H    3.498700     -0.3827000       1.800400    
 H    1.989100      -1.034900       2.440800    
 H    1.049500       2.858900       1.120900    
 H    1.203300       2.841300     -0.6453000    
 H   -1.553100       3.211500      1.8300001E-02
 H   4.0899999E-02   5.047900     -0.7665000    
 H  -0.1112000       5.065800      0.9966000    
 H    1.494800       5.126400      0.2464000    
 H   -3.332800      -2.834900      -1.059700    
 H   -4.906600      -2.617100     -0.2804000    
 H   -3.477400      -2.843500      0.7382000    


%chk=000089022-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089022

0 1
O -3.707857 -0.946849 -0.150162
N 0.897597 -1.729125 0.219914
N 0.106690 0.491472 0.332975
N -0.830867 2.653403 0.313554
N -1.401077 -1.402994 0.025175
N -2.302491 0.857293 0.090165
N 3.128770 0.303955 -1.584747
C 2.328931 -1.380959 0.353164
C 3.139706 -2.695518 0.175559
C 2.637323 -0.736931 1.734960
C -0.153870 -0.837988 0.196636
C 2.742212 -0.430730 -0.728087
C -1.005628 1.300608 0.247325
C 0.471829 3.328359 0.437909
C -2.415922 -0.490992 -0.004660
C 0.437806 4.710907 -0.237489
C -3.892305 -2.408564 -0.269142
H 0.644705 -2.703500 0.046883
H 2.949303 -3.153473 -0.811010
H 4.218725 -2.490074 0.258676
H 2.859207 -3.410291 0.970219
H 2.038686 0.177419 1.861882
H 3.709725 -0.484972 1.808116
H 2.381097 -1.456442 2.532204
H 0.745613 3.433779 1.508256
H 1.232363 2.679268 -0.028010
H -1.688473 3.207390 0.265962
H 0.213511 4.617354 -1.314552
H -0.322642 5.370748 0.222260
H 1.418534 5.206755 -0.131627
H -3.360058 -2.797724 -1.153439
H -4.979702 -2.533261 -0.374634
H -3.518640 -2.923723 0.631865


