%chk=000256864.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256864

0 1
O 0.132059 1.840749 0.034334
N 1.131565 -0.072454 -0.812170
N -0.761682 -0.170536 0.723821
C 3.827970 -0.588476 0.273343
C 3.392671 0.821005 -0.148597
C 2.619784 -1.444048 0.679509
C 2.296243 0.773626 -1.225315
C 1.561434 -1.450919 -0.436515
C 0.169523 0.617529 -0.000935
C -1.999358 0.505585 1.196894
C -3.151584 0.447970 0.183799
C -3.790611 -0.942773 0.085435
C -4.951577 -0.958983 -0.906299
H 4.373925 -1.077833 -0.555996
H 4.543182 -0.524482 1.115034
H 3.016665 1.380699 0.732318
H 4.259816 1.394699 -0.523551
H 2.939488 -2.477529 0.904413
H 2.175622 -1.048581 1.614853
H 1.928287 1.803189 -1.447743
H 2.687749 0.349577 -2.174360
H 1.975675 -1.922409 -1.357602
H 0.683255 -2.062052 -0.143121
H -2.287134 0.025151 2.158084
H -1.755129 1.572622 1.427388
H -0.904471 -1.136356 0.426886
H -2.793571 0.776341 -0.812935
H -3.920041 1.192914 0.471947
H -4.148244 -1.264233 1.083672
H -3.032605 -1.689254 -0.220723
H -4.626053 -0.675985 -1.914297
H -5.401838 -1.955578 -0.974756
H -5.744215 -0.260974 -0.612719


%chk=000256864-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256864

0 1
O -0.129841 1.991678 0.009666
N 1.221780 0.084979 -0.150698
N -0.964100 -0.030052 0.810717
C 4.025105 -0.761091 -0.130541
C 3.630010 0.720510 -0.333230
C 2.956507 -1.486682 0.718489
C 2.219713 0.828072 -0.951518
C 1.545275 -1.332535 0.096125
C 0.033698 0.741993 0.208604
C -2.234743 0.586528 1.227919
C -3.359371 0.482463 0.169391
C -3.789294 -0.967528 -0.149153
C -4.937678 -1.036999 -1.179186
H 4.108488 -1.256750 -1.120561
H 5.016914 -0.839816 0.352996
H 3.639509 1.248163 0.640135
H 4.356146 1.230430 -0.995041
H 3.194282 -2.564347 0.810415
H 2.943676 -1.057842 1.739472
H 1.876336 1.873213 -1.004881
H 2.239979 0.414784 -1.984932
H 1.505040 -1.900675 -0.860553
H 0.810822 -1.786407 0.782456
H -2.562166 0.109981 2.173670
H -2.018726 1.648809 1.431270
H -0.897828 -1.045395 0.831760
H -3.021610 0.989385 -0.755253
H -4.237901 1.048835 0.542150
H -4.102559 -1.472056 0.789131
H -2.917734 -1.533087 -0.538564
H -4.639454 -0.565251 -2.134143
H -5.230133 -2.081610 -1.393367
H -5.833338 -0.503496 -0.808649


