%chk=000020220.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020220

0 1
 O   0.5663000       2.579700     -0.2471000    
 N  -0.2610000      0.4647000      0.2287000    
 N   -4.614000      0.9341000      0.1962000    
 N    1.988200      -1.180300     -0.9602000    
 C   -1.595900       1.052700      0.4326000    
 C   -2.388800       1.170100     -0.8677000    
 C  -0.1820000     -0.9755000      0.2523000    
 C   -3.798200       1.745100     -0.6994000    
 C   0.8195000      -1.715700     -0.3979000    
 C   0.7738000       1.383900     -8.7000001E-03
 C    2.200100       1.023800      0.1009000    
 C    2.748800     -0.1162000     -0.4733000    
 C   -1.237100      -1.704800      0.8577000    
 C   0.7135000      -3.129700     -0.4460000    
 C    3.045100       1.991500      0.6814000    
 C    4.152600     -0.2601000     -0.4689000    
 C   -1.314600      -3.098300      0.8129000    
 C   -4.763000     -0.4239000     -0.3299000    
 C   -5.928100       1.548300      0.3948000    
 C  -0.3396000      -3.815200      0.1481000    
 C    4.428500       1.826000      0.6898000    
 C    4.985900      0.6998000      0.1038000    
 H   -1.455400       2.075700      0.8100000    
 H   -2.152500      0.5915000       1.246300    
 H   -2.416500      0.2072000      -1.390200    
 H   -1.840600       1.834800      -1.549200    
 H   -4.266700       1.840800      -1.687800    
 H   -3.703300       2.760000     -0.2926000    
 H    2.499500      -1.820000      -1.561000    
 H   -2.038700      -1.242400       1.420200    
 H    1.486800      -3.713400     -0.9445000    
 H    2.634500       2.895200       1.127500    
 H    4.608400      -1.149900     -0.9004000    
 H   -2.139100      -3.613700       1.296300    
 H   -5.165700     -0.4319000      -1.349500    
 H   -3.824800     -0.9825000     -0.3180000    
 H   -5.447700      -1.001400      0.3030000    
 H   -6.521700      0.9659000       1.108200    
 H   -5.823200       2.551800      0.8220000    
 H   -6.493100       1.628500     -0.5410000    
 H  -0.3861000      -4.898400      0.1010000    
 H    5.065500       2.580400       1.141300    
 H    6.062400      0.5600000      9.9699996E-02


%chk=000020220-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020220

0 1
O 0.637723 2.726133 0.785103
N -0.250685 0.625118 0.346368
N -4.608003 0.775113 0.037842
N 1.809667 -0.902961 -1.113110
C -1.603182 1.259043 0.279109
C -2.329675 0.952242 -1.046505
C -0.202779 -0.815964 0.345168
C -3.790752 1.451470 -1.003417
C 0.738480 -1.548071 -0.433751
C 0.839599 1.491289 0.539360
C 2.260202 1.010943 0.418683
C 2.705411 -0.019254 -0.459752
C -1.203702 -1.541539 1.044053
C 0.619206 -2.958228 -0.540396
C 3.235449 1.813640 1.070662
C 4.097970 -0.172467 -0.710338
C -1.314158 -2.943453 0.938048
C -4.923363 -0.628900 -0.299833
C -5.828787 1.539220 0.370242
C -0.409042 -3.657768 0.121433
C 4.613455 1.630842 0.856453
C 5.043321 0.644021 -0.064117
H -1.435639 2.342158 0.391354
H -2.236431 0.938853 1.124422
H -2.302531 -0.132398 -1.260417
H -1.805347 1.453922 -1.882291
H -4.249079 1.335873 -2.019816
H -3.791676 2.535121 -0.774623
H 2.255544 -1.488330 -1.824461
H -1.922373 -0.996639 1.662401
H 1.352393 -3.505387 -1.146793
H 2.869487 2.620684 1.712620
H 4.432465 -0.955125 -1.403458
H -2.103305 -3.468651 1.485847
H -5.533123 -0.725379 -1.235112
H -3.996862 -1.212354 -0.434506
H -5.493232 -1.087677 0.528212
H -6.360082 1.045999 1.204317
H -5.554308 2.558497 0.695082
H -6.544346 1.628718 -0.486838
H -0.488421 -4.744754 0.016064
H 5.341797 2.261108 1.376071
H 6.110715 0.503493 -0.267981


