%chk=000270577.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270577

0 1
O -2.437958 2.586120 -0.723653
O 2.437870 2.586166 0.723223
O -2.757400 1.200825 -2.355698
O 2.757216 1.201091 2.355473
N -2.830794 1.532245 -1.184138
N 2.830645 1.532337 1.183866
C -2.897761 -0.859037 -0.377649
C 2.897519 -0.859082 0.377733
C -3.496164 0.558998 -0.205346
C 3.495979 0.558911 0.205222
C -1.399064 -0.844530 -0.165466
C 1.398813 -0.844555 0.165543
C -3.603484 -1.836188 0.585315
C 3.603223 -1.836414 -0.585074
C -5.008549 0.573245 -0.493096
C 5.008370 0.573147 0.492969
C -0.550379 -0.832803 -1.283073
C 0.835571 -0.828669 -1.118340
C -0.835823 -0.828465 1.118414
C 0.550126 -0.832623 1.283149
C -5.091692 -1.672264 0.598389
C 5.091440 -1.672545 -0.598158
C -5.717813 -0.586439 0.136320
C 5.717596 -0.586666 -0.136258
H -3.117776 -1.194420 -1.428385
H 3.117514 -1.194312 1.428523
H -3.295220 0.935965 0.832002
H 3.295051 0.935732 -0.832183
H -3.225959 -1.704364 1.624024
H -3.331611 -2.874931 0.302771
H 3.225718 -1.704740 -1.623811
H 3.331311 -2.875104 -0.302373
H -5.193150 0.541457 -1.593432
H -5.448749 1.529197 -0.137367
H 5.192972 0.541528 1.593311
H 5.448607 1.529026 0.137088
H -0.974022 -0.808626 -2.289672
H 1.479490 -0.810417 -1.998296
H -1.479744 -0.810054 1.998364
H 0.973770 -0.808301 2.289744
H -5.641021 -2.505320 1.037738
H 5.640743 -2.505691 -1.037367
H -6.803028 -0.488428 0.172124
H 6.802815 -0.488702 -0.172068


%chk=000270577-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270577

0 1
O -2.565106 2.659397 0.344673
O 2.565017 2.659254 -0.345568
O -2.966433 1.889400 -1.766003
O 2.966384 1.889908 1.765337
N -3.012792 1.784525 -0.482075
N 3.012636 1.784595 0.481440
C -2.929267 -0.742339 -0.437697
C 2.929030 -0.742278 0.437825
C -3.667002 0.521781 0.092998
C 3.666810 0.521660 -0.093253
C -1.419818 -0.705591 -0.203693
C 1.419582 -0.705560 0.203809
C -3.582519 -1.998620 0.210012
C 3.582242 -1.998779 -0.209500
C -5.160195 0.521901 -0.309484
C 5.160002 0.521847 0.309230
C -0.525584 -0.691039 -1.302698
C 0.870746 -0.694259 -1.103706
C -0.870981 -0.693880 1.103819
C 0.525348 -0.690628 1.302810
C -5.097006 -1.947262 0.233033
C 5.096730 -1.947476 -0.232550
C -5.807596 -0.815668 -0.007299
C 5.807357 -0.815831 0.007437
H -3.116529 -0.775769 -1.527929
H 3.116289 -0.775376 1.528067
H -3.548275 0.619445 1.185036
H 3.548084 0.618997 -1.185321
H -3.198208 -2.136776 1.241586
H -3.242330 -2.891531 -0.350276
H 3.197920 -2.137244 -1.241028
H 3.242030 -2.891507 0.351067
H -5.238117 0.754538 -1.390621
H -5.688970 1.332291 0.228289
H 5.237931 0.754800 1.390298
H 5.688805 1.332059 -0.228783
H -0.928966 -0.669705 -2.321863
H 1.531438 -0.681469 -1.979541
H -1.531672 -0.680790 1.979652
H 0.928730 -0.668974 2.321968
H -5.624492 -2.883319 0.459308
H 5.624185 -2.883617 -0.458545
H -6.904678 -0.839302 0.011570
H 6.904438 -0.839507 -0.011429


