%chk=000189348.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189348

0 1
P 3.166522 0.164017 -0.017557
O 4.058342 -1.002158 0.757654
O 3.723762 1.560253 0.688372
O 3.340402 0.136767 -1.487584
O -1.054115 -0.979562 1.174675
N -2.019238 0.200721 -0.512994
N -3.957447 0.376082 1.017060
C 1.505884 -0.002829 0.767387
C 0.437801 0.272586 -0.277147
C -3.409166 -0.290479 -0.179350
C -0.911093 -0.237196 0.217423
C -4.313723 -0.043077 -1.386911
H 1.411965 0.680135 1.641880
H 1.378796 -1.022653 1.212712
H 0.378245 1.358440 -0.510324
H 0.659953 -0.230339 -1.250563
H -3.330611 -1.393808 0.048314
H -1.914940 0.830710 -1.300931
H -4.386562 1.014842 -1.661947
H -3.978953 -0.603106 -2.267380
H -5.338596 -0.375743 -1.157163
H -3.421533 0.149185 1.853409
H -4.001447 1.384400 0.929352
H 4.801249 -1.406121 0.241649
H 4.486705 2.010133 0.248064


%chk=000189348-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189348

0 1
P 3.225383 0.011066 0.117735
O 4.075158 -0.084919 1.627960
O 3.183170 1.703254 -0.288211
O 3.851610 -0.897678 -1.035141
O -1.085232 -1.425149 0.811468
N -1.995016 0.190673 -0.583190
N -3.810514 -0.072967 1.106315
C 1.483952 -0.217732 0.686261
C 0.467796 0.016933 -0.445705
C -3.417285 -0.230612 -0.285239
C -0.927199 -0.465055 -0.010004
C -4.355673 0.548962 -1.219509
H 1.330099 0.478096 1.527429
H 1.387768 -1.245618 1.074364
H 0.452471 1.081935 -0.740161
H 0.760572 -0.566641 -1.341970
H -3.463361 -1.311004 -0.511096
H -1.828633 0.982636 -1.209151
H -4.328000 1.633794 -0.997779
H -4.083501 0.399004 -2.279518
H -5.388179 0.197692 -1.067412
H -3.282680 -0.676719 1.744522
H -3.883365 0.896698 1.428797
H 5.012290 -0.396387 1.543850
H 3.930569 2.000938 -0.866514


