%chk=000259706.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259706

0 1
O -1.982754 0.194060 1.540188
O 1.982408 0.196938 -1.539485
N -3.043686 0.162175 -0.491339
N 3.043438 0.162977 0.491972
C -3.656020 -1.279700 -2.405191
C 3.656719 -1.281066 2.403908
C -2.983006 0.029311 -1.976215
C 2.982884 0.028093 1.976683
C -5.135435 -1.260577 -2.008094
C 5.136121 -1.260445 2.006850
C -5.380070 -0.641956 -0.658475
C 5.380309 -0.640039 0.657968
C -4.372340 0.038652 0.066943
C 4.372142 0.040909 -0.066533
C -1.894241 0.162410 0.320826
C 1.893947 0.163642 -0.320163
C -6.667611 -0.725708 -0.109888
C 6.667863 -0.722387 0.109198
C -4.671064 0.617379 1.313786
C 4.670489 0.621392 -1.312660
C -0.561041 0.169424 -0.361655
C 0.560739 0.169141 0.362325
C -6.959732 -0.153956 1.129753
C 6.959598 -0.148908 -1.129736
C -5.959203 0.516507 1.838939
C 5.958657 0.521904 -1.838010
H -3.145771 -2.142697 -1.931602
H -3.549970 -1.424514 -3.496611
H 3.147029 -2.143753 1.929154
H 3.550755 -1.427417 3.495133
H -1.929718 0.069511 -2.336934
H -3.507495 0.906290 -2.423008
H 1.929588 0.067154 2.337516
H 3.506846 0.904801 2.424629
H -5.536325 -2.295922 -2.024207
H -5.721664 -0.699544 -2.767843
H 5.537749 -2.295521 2.021755
H 5.721947 -0.699885 2.767261
H -7.451760 -1.247150 -0.657355
H 7.452337 -1.244071 0.655968
H -3.890977 1.132324 1.882815
H 3.890101 1.136646 -1.880998
H -0.534809 0.173055 -1.461042
H 0.534488 0.171200 1.461722
H -7.963396 -0.231771 1.542176
H 7.963282 -0.225641 -1.542311
H -6.181220 0.962939 2.807302
H 6.180373 0.969695 -2.805815


%chk=000259706-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259706

0 1
O -1.970442 0.384539 1.556119
O 1.969496 0.388720 -1.555119
N -3.048358 -0.158041 -0.471840
N 3.048484 -0.154185 0.472354
C -3.913595 -2.096388 -1.763012
C 3.912880 -2.095132 1.760140
C -2.952604 -0.891584 -1.765927
C 2.952683 -0.889707 1.765282
C -5.361558 -1.589400 -1.660352
C 5.361120 -1.588880 1.657853
C -5.508903 -0.496433 -0.607278
C 5.508857 -0.494235 0.606570
C -4.383786 0.166763 -0.025587
C 4.384003 0.170649 0.026269
C -1.903269 0.078670 0.320411
C 1.903142 0.083773 -0.319136
C -6.810492 -0.116350 -0.199912
C 6.810600 -0.114249 0.199604
C -4.601688 1.188153 0.942632
C 4.602378 1.193681 -0.940130
C -0.574767 0.008459 -0.365678
C 0.574792 0.009282 0.366786
C -7.025587 0.894133 0.756962
C 7.026138 0.897799 -0.755507
C -5.907098 1.546752 1.325325
C 5.907940 1.552162 -1.322424
H -3.665263 -2.750106 -0.906181
H -3.768744 -2.683839 -2.688157
H 3.663863 -2.747301 0.902327
H 3.767941 -2.683980 2.684382
H -1.922644 -1.245673 -1.904691
H -3.206485 -0.208337 -2.600766
H 1.922500 -1.243317 1.903762
H 3.207253 -0.207939 2.601116
H -6.050718 -2.423006 -1.429447
H -5.678476 -1.189553 -2.645712
H 6.049679 -2.422540 1.425354
H 5.678598 -1.190876 2.643776
H -7.668078 -0.634219 -0.648052
H 7.667954 -0.633432 0.646664
H -3.747519 1.683382 1.403790
H 3.748460 1.690314 -1.400214
H -0.484967 0.046713 -1.456810
H 0.484936 0.045385 1.457995
H -8.043091 1.166103 1.057222
H 8.043751 1.169671 -1.055486
H -6.047468 2.336406 2.071444
H 6.048651 2.343095 -2.067122


