%chk=000162043.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162043

0 1
 O   -3.542100      -3.130300       1.377300    
 O    7.034500      -1.045900     -0.4567000    
 O    7.113000      0.6945000      0.8791000    
 N   -5.157600      0.9165000     -0.4363000    
 N   -1.537300      -1.944300       1.016200    
 N   0.3293000      6.0500000E-02  0.2957000    
 N   0.9622000      0.7009000     -0.5728000    
 N    6.476900     -9.0099998E-02  0.1347000    
 N    1.678300      -2.176900      -2.582100    
 N    1.926200       3.336800       1.653900    
 C   -3.776900      0.6952000     -0.2506000    
 C   -6.066400      0.8703000      0.6917000    
 C   -5.687200       1.178900      -1.759700    
 C   -3.330500     -0.5109000      0.2895000    
 C   -2.858100       1.682800     -0.6059000    
 C   -1.965300     -0.7293000      0.4743000    
 C   -6.182200       2.243100       1.325700    
 C   -6.054500     -0.1242000      -2.443200    
 C   -1.050800      0.2590000      0.1183000    
 C   -1.493100       1.464500     -0.4212000    
 C   -2.320100      -3.031600       1.422000    
 C    2.342500      0.5022000     -0.3948000    
 C    2.984500     -0.5528000      -1.042900    
 C    3.070300       1.361300      0.4286000    
 C   -1.473400      -4.159800       1.955600    
 C    5.082400      0.1103000     -4.4599999E-02
 C    4.354300     -0.7489000     -0.8678000    
 C    4.440200       1.165400      0.6037000    
 C    2.262600      -1.450400      -1.893700    
 C    2.438000       2.453100       1.105800    
 H   -5.744600      0.1452000       1.447900    
 H   -7.060700      0.5436000      0.3637000    
 H   -4.973200       1.730400      -2.382100    
 H   -6.580600       1.811200      -1.690800    
 H   -4.089900      -1.241300      0.5277000    
 H   -3.190400       2.634400      -1.013000    
 H   -5.215000       2.586900       1.707500    
 H   -6.540000       2.985900      0.6051000    
 H   -6.886300       2.216600       2.163300    
 H   -5.177000     -0.7671000      -2.569700    
 H   -6.797200     -0.6829000      -1.864100    
 H   -6.475300      7.2400004E-02  -3.434300    
 H  -0.8171000       2.273100     -0.6877000    
 H  -0.5293000      -2.037100       1.123500    
 H  -0.8028000      -4.521400       1.171000    
 H   -2.115100      -4.982800       2.282000    
 H  -0.8840000      -3.810300       2.808000    
 H    4.837000      -1.578000      -1.381800    
 H    4.990700       1.846300       1.250300    


%chk=000162043-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000162043

0 1
O -3.515417 -3.006850 1.590681
O 7.096911 -1.251093 0.721731
O 7.493825 0.730351 -0.348613
N -5.271968 0.931715 -0.495873
N -1.536909 -1.892348 0.982936
N 0.232260 -0.077643 0.027356
N 1.108605 0.818425 -0.439043
N 6.699372 -0.169910 0.132427
N 1.515625 -2.652942 1.428595
N 2.552317 3.621767 -1.946831
C -3.914707 0.703104 -0.374602
C -6.276825 -0.080759 -0.078125
C -5.819098 2.200290 -1.038779
C -3.434812 -0.491938 0.250682
C -2.952856 1.664690 -0.882123
C -2.058036 -0.740497 0.374332
C -6.644120 0.010822 1.419690
C -5.968956 2.187517 -2.576574
C -1.098989 0.230999 -0.134384
C -1.595214 1.425838 -0.759486
C -2.248865 -2.963947 1.551822
C 2.445734 0.470490 -0.246924
C 2.965339 -0.717476 0.397117
C 3.397732 1.428355 -0.757604
C -1.370102 -4.068301 2.117655
C 5.248188 0.050688 0.000369
C 4.359375 -0.913717 0.514181
C 4.784820 1.221517 -0.636145
C 2.112834 -1.737544 0.940446
C 2.910638 2.618998 -1.403567
H -5.902803 -1.089676 -0.322378
H -7.179061 0.080898 -0.695889
H -5.185889 3.044271 -0.715464
H -6.807161 2.356891 -0.569085
H -4.111861 -1.236053 0.666743
H -3.288819 2.575859 -1.382349
H -5.765475 -0.178852 2.058629
H -7.047986 1.008147 1.670956
H -7.413110 -0.743612 1.663890
H -4.991975 2.059325 -3.073715
H -6.627734 1.363443 -2.903774
H -6.412686 3.138359 -2.922828
H -0.857559 2.137141 -1.142713
H -0.506791 -1.948420 1.010691
H -0.724337 -4.504802 1.335834
H -2.018620 -4.848160 2.540639
H -0.693391 -3.680990 2.898855
H 4.763072 -1.806516 0.999785
H 5.504382 1.947144 -1.022874


