%chk=000264959.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264959

0 1
O -2.924643 2.244431 -0.611619
O 0.601758 -1.480985 -1.454187
N 1.166000 0.589074 -0.607403
C -2.091638 -0.044922 -0.490764
C -3.331338 0.866071 -0.674418
C -2.524097 -1.521218 -0.525096
C -4.405232 0.583446 0.385593
C -3.589235 -1.810078 0.538418
C -4.809879 -0.894932 0.367843
C -1.058901 0.260021 -1.591274
C 0.291312 -0.327112 -1.234000
C 2.497436 0.318338 -0.154932
C 3.201710 1.380837 0.451805
C 3.100713 -0.943254 -0.296351
C 4.501728 1.166168 0.909913
C 4.402126 -1.133839 0.169654
C 5.107100 -0.087150 0.772666
H -1.635758 0.174919 0.505157
H -3.742565 0.795328 -1.706554
H -1.637857 -2.172281 -0.374267
H -2.909862 -1.784441 -1.528859
H -5.285995 1.228026 0.199728
H -4.036494 0.862771 1.390513
H -3.158780 -1.682193 1.550272
H -3.901461 -2.870112 0.475773
H -5.327361 -1.131990 -0.582323
H -5.545474 -1.091581 1.170718
H -1.023058 1.356062 -1.772945
H -1.383042 -0.178286 -2.560274
H -2.667257 2.499364 0.293032
H 0.834973 1.544140 -0.452641
H 2.745900 2.360274 0.563944
H 2.557129 -1.768587 -0.768266
H 5.048166 1.984412 1.378094
H 4.870903 -2.112026 0.059766
H 6.120375 -0.246497 1.131985


%chk=000264959-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264959

0 1
O -2.798340 2.290037 -0.346591
O 0.553962 -1.632386 -1.257671
N 1.245926 0.536227 -0.670166
C -2.131475 -0.121002 -0.468523
C -3.292058 0.905445 -0.545301
C -2.672142 -1.564858 -0.644424
C -4.414448 0.574296 0.459158
C -3.781518 -1.894988 0.379066
C -4.938575 -0.872271 0.287358
C -1.034564 0.224764 -1.520494
C 0.317595 -0.389341 -1.158527
C 2.571573 0.317318 -0.196225
C 3.308225 1.456720 0.229931
C 3.170441 -0.970043 -0.134696
C 4.624612 1.314749 0.712224
C 4.490501 -1.093986 0.350972
C 5.226051 0.035802 0.776420
H -1.689979 -0.035971 0.550355
H -3.697277 0.923518 -1.574993
H -1.831305 -2.277512 -0.572027
H -3.082996 -1.665316 -1.671605
H -5.232364 1.309969 0.343099
H -4.010850 0.691323 1.489695
H -3.356853 -1.879255 1.404197
H -4.161558 -2.920002 0.206650
H -5.431884 -0.967169 -0.701792
H -5.711096 -1.083683 1.051121
H -0.969897 1.325435 -1.608374
H -1.341024 -0.180583 -2.502678
H -2.628744 2.415350 0.622849
H 0.930808 1.509258 -0.655455
H 2.849574 2.453441 0.180936
H 2.601445 -1.839822 -0.467234
H 5.179647 2.202166 1.036136
H 4.946695 -2.089489 0.394917
H 6.249293 -0.075939 1.150391


