%chk=000240865.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240865

0 1
O 1.107246 1.022904 -0.037405
O 0.082650 -2.653695 -1.230278
O -1.487295 3.747763 0.985734
O 1.149621 -2.159119 0.589599
O 0.574227 3.083370 1.029244
O -4.647118 -1.505099 0.117025
O -5.067481 0.552881 0.654239
N 0.302084 -1.963378 -0.256942
N -0.615670 2.904570 0.875113
N -4.317364 -0.360328 0.367187
C -0.124283 0.531564 0.142405
C -0.593239 -0.796096 -0.052676
C -1.066908 1.536349 0.538642
C 2.155338 0.242468 -0.617025
C -2.872867 -0.054825 0.318771
C 3.239647 -0.071795 0.217229
C -1.962081 -1.072542 -0.002987
C -2.428415 1.244541 0.611332
C 2.119378 -0.006371 -1.991078
C 4.343912 -0.686961 -0.400441
C 3.199389 0.211896 1.674709
C 3.231403 -0.621697 -2.565666
C 4.336015 -0.959473 -1.769254
H -2.336264 -2.092069 -0.208370
H -3.153545 2.033297 0.892601
H 1.256868 0.278683 -2.590810
H 5.210996 -0.957236 0.203629
H 2.659015 1.148130 1.896754
H 2.678182 -0.600712 2.210702
H 4.199488 0.304878 2.119113
H 3.241004 -0.839890 -3.633695
H 5.200468 -1.443208 -2.227603


%chk=000240865-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240865

0 1
O 1.171456 0.747711 0.442803
O -0.219966 -3.100373 -0.639194
O -1.313148 3.805073 0.413602
O 1.225951 -2.097357 0.820309
O 0.312483 2.952610 1.777507
O -4.796985 -1.444490 -0.349765
O -5.188346 0.752535 0.146259
N 0.169346 -2.105887 0.081551
N -0.657830 2.827138 0.945489
N -4.406237 -0.256020 -0.037397
C -0.150909 0.406720 0.378288
C -0.688526 -0.895437 0.108069
C -1.105037 1.454574 0.589541
C 2.189278 0.149209 -0.389418
C -2.949268 -0.031620 0.121027
C 3.446011 -0.038532 0.231344
C -2.067476 -1.112320 -0.045518
C -2.484070 1.256093 0.447064
C 1.944967 -0.079762 -1.756818
C 4.490527 -0.505096 -0.604573
C 3.630368 0.218909 1.709302
C 3.009236 -0.550519 -2.556730
C 4.281178 -0.764726 -1.978283
H -2.445765 -2.113010 -0.272532
H -3.182560 2.088148 0.570779
H 0.964369 0.125249 -2.199554
H 5.479667 -0.670415 -0.163257
H 3.256440 1.218613 1.993246
H 3.054101 -0.517494 2.299942
H 4.691762 0.140932 1.996264
H 2.844568 -0.734429 -3.623082
H 5.108815 -1.127228 -2.596469


