%chk=000254441.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254441

0 1
O -0.902482 -0.175430 -1.197178
O -4.691762 1.641031 0.753675
O 3.038264 0.701829 2.243321
O 2.881510 1.710125 -2.273939
N -2.719404 1.052799 -0.362491
N 2.938460 1.550825 0.061335
C 0.140322 2.729682 -0.268228
C -1.301923 3.059997 0.132122
C 1.135852 3.112631 0.831337
C -2.326260 2.411505 -0.811708
C 2.595325 2.957343 0.378611
C -1.934687 -0.132922 -0.579262
C -3.893889 0.799557 0.434037
C 3.078219 0.519686 1.054253
C 2.987928 1.034369 -1.284864
C -2.697735 -1.231713 0.109746
C -3.860920 -0.676887 0.712998
C 3.291970 -0.744978 0.267806
C 3.232185 -0.439816 -1.120914
C -2.415528 -2.576569 0.206728
C -4.746589 -1.464010 1.415819
C 3.512229 -2.032012 0.707086
C 3.386067 -1.420977 -2.075742
C -3.322962 -3.388633 0.929035
C -4.458863 -2.846483 1.518374
C 3.673774 -3.042388 -0.271173
C 3.610887 -2.744864 -1.627379
H 0.399164 3.244676 -1.214639
H 0.230472 1.645062 -0.496055
H -1.451239 4.157969 0.129234
H -1.494438 2.744535 1.177184
H 0.958316 2.495390 1.736443
H 0.974210 4.162045 1.147782
H -1.921495 2.333961 -1.847234
H -3.251913 3.032877 -0.859139
H 3.281244 3.308192 1.184129
H 2.794906 3.573254 -0.529999
H -1.525478 -3.005605 -0.254570
H -5.639313 -1.042132 1.879306
H 3.560932 -2.269254 1.770164
H 3.334099 -1.191180 -3.140705
H -3.118232 -4.456511 1.019085
H -5.146437 -3.488255 2.071578
H 3.849856 -4.068215 0.054855
H 3.734956 -3.537305 -2.366725


%chk=000254441-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000254441

0 1
O -1.948884 0.331353 -2.302979
O -3.729800 1.464058 1.909202
O 2.957019 0.987407 2.309108
O 2.763410 1.290638 -2.388124
N -2.762773 1.236802 -0.253895
N 2.777955 1.479326 -0.012810
C 0.000789 2.749448 -0.258137
C -1.371005 3.286926 0.204291
C 1.155173 3.310484 0.601145
C -2.574195 2.668763 -0.546331
C 2.563358 2.933204 0.084589
C -2.437840 0.179176 -1.156210
C -3.329604 0.746126 0.958505
C 2.954172 0.618349 1.107321
C 2.854453 0.768526 -1.250077
C -2.810532 -1.086616 -0.443283
C -3.343048 -0.747363 0.824089
C 3.136839 -0.756800 0.535832
C 3.075597 -0.666242 -0.875969
C -2.702206 -2.421881 -0.858631
C -3.784753 -1.732259 1.719698
C 3.344072 -1.984640 1.181468
C 3.217790 -1.799382 -1.690146
C -3.145201 -3.426945 0.040763
C -3.677949 -3.087335 1.310296
C 3.489310 -3.138407 0.367110
C 3.426749 -3.047334 -1.046698
H 0.163622 3.004644 -1.324247
H 0.003057 1.642956 -0.202688
H -1.409761 4.383821 0.047661
H -1.502759 3.120116 1.290749
H 1.047313 2.969820 1.648427
H 1.102347 4.418171 0.619376
H -2.437412 2.751186 -1.639939
H -3.503353 3.194482 -0.260667
H 3.333767 3.349986 0.758761
H 2.724782 3.334779 -0.932309
H -2.291599 -2.671071 -1.842063
H -4.195887 -1.458068 2.696228
H 3.391694 -2.042670 2.273375
H 3.167796 -1.715450 -2.780171
H -3.076656 -4.481181 -0.248310
H -4.012337 -3.884250 1.983174
H 3.653205 -4.114777 0.835758
H 3.542885 -3.954672 -1.649143


