%chk=000199376.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199376

0 1
O 1.502735 0.082055 -2.088569
N -2.625010 -0.375586 -0.570702
N -5.314182 -0.064340 0.489418
C -0.161748 -0.753329 -0.494574
C -1.298560 0.145290 -1.041185
C 1.231125 -0.071203 -0.672827
C -2.862181 -0.028471 0.869819
C -3.734830 0.188872 -1.409756
C -4.205638 -0.629502 1.328276
C -5.078965 -0.411810 -0.951333
C -0.173383 -2.117291 -1.185888
C 1.340146 1.306891 -0.023146
C 2.352527 -0.967642 -0.158334
C -6.633546 -0.596689 0.943862
C 2.169039 2.268198 -0.620915
C 2.474709 -1.222241 1.215510
C 0.667959 1.621462 1.165412
C 3.261819 -1.545949 -1.054807
C 2.309434 3.533623 -0.046879
C 3.497049 -2.051431 1.684678
C 0.810911 2.888428 1.739490
C 4.283777 -2.372864 -0.580785
C 1.628581 3.847210 1.134067
C 4.402670 -2.628533 0.788682
H -0.326032 -0.913618 0.601603
H -1.130520 1.206716 -0.755597
H -1.283693 0.109580 -2.152917
H -2.861143 1.068240 1.055034
H -2.039305 -0.471132 1.472208
H -3.551587 -0.095773 -2.467584
H -3.788939 1.298681 -1.364781
H -4.152239 -1.739264 1.285304
H -4.392235 -0.346443 2.385719
H -5.901212 0.029672 -1.553273
H -5.080782 -1.507790 -1.138687
H -1.189397 -2.535573 -1.196289
H 0.173229 -2.045859 -2.224210
H 0.479412 -2.833989 -0.674764
H 0.779258 0.573740 -2.523352
H -6.801655 -0.290561 1.988911
H -6.742406 -1.689300 0.881161
H -7.432169 -0.133306 0.342496
H 2.710142 2.012458 -1.535483
H 1.782399 -0.770156 1.922882
H 0.030146 0.884047 1.650515
H 3.165303 -1.343811 -2.124774
H 2.954284 4.274140 -0.517170
H 3.589163 -2.245736 2.751490
H 0.284627 3.127109 2.662007
H 4.988011 -2.817906 -1.281269
H 1.738380 4.832791 1.582186
H 5.198124 -3.272902 1.156621


%chk=000199376-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000199376

0 1
O 1.381919 0.159000 -2.138610
N -2.667569 -0.361991 -0.533208
N -5.411291 -0.152516 0.395222
C -0.165100 -0.724677 -0.406510
C -1.338974 0.103416 -1.001816
C 1.218053 -0.021291 -0.670810
C -2.982953 0.052271 0.856387
C -3.764671 0.046805 -1.446662
C -4.319444 -0.558072 1.310454
C -5.099222 -0.566285 -0.993106
C -0.202070 -2.160882 -0.973226
C 1.368776 1.359225 0.016439
C 2.376775 -0.938292 -0.228983
C -6.731743 -0.631523 0.844371
C 2.322630 2.271725 -0.508867
C 2.590859 -1.188800 1.150021
C 0.647190 1.736871 1.177183
C 3.221205 -1.560252 -1.178874
C 2.540112 3.526151 0.099661
C 3.624254 -2.052685 1.572061
C 0.864137 2.992275 1.789369
C 4.260482 -2.420539 -0.756060
C 1.809777 3.894341 1.253574
C 4.465316 -2.673976 0.619099
H -0.292632 -0.792970 0.691845
H -1.195704 1.193737 -0.793340
H -1.319395 -0.028277 -2.102031
H -3.045577 1.167076 0.943094
H -2.183585 -0.300793 1.533605
H -3.526177 -0.309199 -2.466334
H -3.877844 1.160019 -1.482586
H -4.208623 -1.672471 1.350478
H -4.559867 -0.200306 2.329550
H -5.910574 -0.216389 -1.658995
H -5.031252 -1.681118 -1.083983
H -1.235723 -2.542966 -0.908346
H 0.113689 -2.164002 -2.032537
H 0.464492 -2.841349 -0.416784
H 0.779635 0.892822 -2.421255
H -6.942090 -0.245771 1.858327
H -6.812551 -1.748273 0.875264
H -7.515929 -0.251291 0.165025
H 2.900413 1.979782 -1.392208
H 1.962769 -0.695187 1.900907
H -0.094864 1.061055 1.615466
H 3.056086 -1.360090 -2.240431
H 3.283203 4.213077 -0.321356
H 3.778843 -2.233832 2.641933
H 0.291945 3.264449 2.683683
H 4.908461 -2.894529 -1.502487
H 1.977231 4.867473 1.728560
H 5.270774 -3.341773 0.945325


