%chk=000270197.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270197

0 1
O -2.318045 -1.049174 -2.173138
O -1.560133 1.538880 0.312361
O -4.147006 1.077141 0.376854
O -4.409191 -0.610616 2.593655
O 0.068745 -2.388911 -0.882391
N 0.396426 0.112370 -2.266348
N 2.163155 -3.136305 -0.480783
N 1.815791 -4.500448 -0.655319
C -2.071555 0.270326 -1.697582
C -1.920257 0.227623 -0.156287
C -0.856006 0.891093 -2.426551
C -3.282498 -0.053189 0.516300
C 1.192241 0.344958 -1.119464
C -3.124921 -0.358573 2.017696
C 1.708840 -0.724706 -0.347979
C 1.562215 1.670670 -0.784918
C 2.449310 1.930453 0.254335
C 2.985374 0.852053 1.013828
C 2.608338 -0.448468 0.700248
C 2.830189 3.338609 0.568006
C 1.234555 -2.104059 -0.588390
C 3.937278 1.107608 2.136595
H -3.004426 0.818954 -1.985110
H -1.151531 -0.520707 0.144735
H -0.722521 1.946049 -2.101669
H -1.077043 0.919481 -3.521856
H -3.839957 -0.865503 -0.013202
H 0.232188 -0.882730 -2.486149
H -2.564259 -1.291454 2.207623
H -2.652039 0.482914 2.556943
H 1.177219 2.492422 -1.390306
H -1.640428 -1.693233 -1.830833
H -0.585364 1.622821 0.391200
H 2.999289 -1.275757 1.296827
H -3.661427 1.906860 0.614623
H 2.328639 4.074083 -0.075882
H 2.585707 3.601163 1.608409
H 3.913489 3.493726 0.444390
H 3.482200 1.739657 2.913042
H 4.267262 0.184769 2.631611
H 4.843318 1.621713 1.783849
H -5.052370 0.067384 2.267286
H 3.160588 -3.000190 -0.311003
H 1.394817 -4.634674 -1.587697
H 1.076202 -4.756382 0.016642


%chk=000270197-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270197

0 1
O -2.286322 -1.243545 -1.974527
O -1.570964 1.737202 0.224277
O -4.162507 1.345814 0.438645
O -4.474767 -0.194725 2.726008
O 0.290938 -2.572654 -1.343309
N 0.306018 0.057240 -2.263596
N 2.348690 -3.206382 -0.517729
N 2.107555 -4.588850 -0.739403
C -2.121270 0.185607 -1.678194
C -1.975991 0.360671 -0.141372
C -0.951805 0.794580 -2.501965
C -3.324276 0.133968 0.574609
C 1.144430 0.280222 -1.172653
C -3.164985 -0.184232 2.073836
C 1.779745 -0.815883 -0.485131
C 1.434649 1.606976 -0.724862
C 2.330404 1.871300 0.332327
C 2.970593 0.781721 1.009670
C 2.677465 -0.527068 0.580933
C 2.617042 3.303460 0.740540
C 1.414479 -2.224782 -0.812992
C 3.924503 1.026457 2.164387
H -3.065593 0.657265 -2.005006
H -1.229613 -0.369902 0.236523
H -0.840084 1.865837 -2.270216
H -1.204035 0.703873 -3.572883
H -3.886525 -0.671057 0.072446
H 0.224898 -0.932098 -2.525414
H -2.740814 -1.194244 2.215873
H -2.490911 0.564848 2.545102
H 1.016868 2.450661 -1.285706
H -1.483228 -1.752940 -1.655481
H -0.579217 1.801373 0.252909
H 3.119770 -1.358244 1.144291
H -3.539049 2.116089 0.553545
H 2.031286 4.021219 0.142756
H 2.380949 3.474349 1.808090
H 3.688710 3.548634 0.611880
H 3.436098 1.571943 2.994756
H 4.310250 0.076263 2.571585
H 4.795838 1.635097 1.854256
H -4.983790 0.555959 2.313461
H 3.306800 -2.967070 -0.261606
H 1.773183 -4.739856 -1.702549
H 1.416985 -4.946395 -0.063909


