%chk=000222076.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222076

0 1
O 2.000984 0.817733 1.542023
O 3.068293 2.140010 -1.210308
O 2.758701 -1.286357 -1.217287
O 1.899911 -2.681627 0.561536
N 0.027510 1.427757 0.396857
N -2.165464 1.854828 0.980017
N -0.349345 -0.668492 -0.924854
N -2.754182 -1.302693 -1.018596
N -4.443550 -0.021360 0.008849
N -1.102193 -2.547737 -2.147254
C 2.196532 1.065904 -0.843666
C 1.491350 1.578748 0.435353
C 3.029648 -0.171029 -0.400596
C 2.695924 -0.381869 1.101171
C 1.796509 -1.575872 1.464381
C -0.743819 0.399977 -0.168890
C -0.910625 2.273528 1.108284
C -2.105979 0.690390 0.192264
C -3.116214 -0.205657 -0.270221
C -1.408496 -1.476326 -1.322295
H 1.512978 0.821574 -1.686687
H 1.753184 2.640517 0.682916
H 4.118980 0.008594 -0.558525
H 3.618286 -0.368595 1.723920
H 0.722188 -1.300968 1.408007
H 2.019133 -1.940387 2.484285
H 3.359963 2.033768 -2.142324
H 1.791833 -1.571044 -1.117077
H -0.569053 3.139378 1.657752
H 2.842125 -2.867956 0.340821
H -4.739318 0.761894 0.572386
H -5.138018 -0.671966 -0.322337
H -0.142217 -2.856824 -2.205913
H -1.812658 -3.250042 -2.304394


%chk=000222076-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222076

0 1
O 1.732711 0.405036 1.515785
O 3.148104 2.176849 -0.823179
O 1.934419 -1.357417 -1.120775
O 3.465402 -2.763353 0.640533
N -0.127395 1.396429 0.391179
N -2.305458 2.070208 0.697710
N -0.561940 -0.803495 -0.694904
N -2.960336 -1.261338 -0.962485
N -4.617701 0.247340 -0.235510
N -1.339623 -2.775022 -1.702010
C 2.128243 1.117831 -0.778750
C 1.332686 1.415633 0.528018
C 2.755694 -0.291772 -0.565215
C 2.898968 -0.366239 0.979968
C 2.822942 -1.805233 1.542163
C -0.931233 0.373379 -0.116487
C -1.016135 2.385672 0.877937
C -2.264938 0.807281 0.073406
C -3.296605 -0.072079 -0.376603
C -1.630485 -1.574430 -1.100724
H 1.489335 1.135151 -1.682600
H 1.610532 2.426978 0.879160
H 3.741065 -0.366365 -1.056582
H 3.827170 0.155255 1.285541
H 1.752884 -2.047532 1.707788
H 3.358617 -1.885722 2.500999
H 3.732028 2.034554 -1.610013
H 0.909879 -1.173001 -0.917504
H -0.648381 3.296369 1.345855
H 2.949805 -2.692000 -0.217167
H -4.876581 1.128275 0.204470
H -5.327674 -0.403912 -0.563457
H -0.373575 -3.061400 -1.841208
H -2.109522 -3.364131 -2.005740


