%chk=000254049.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254049

0 1
O 0.307075 0.158282 1.481022
N -3.828271 2.176894 0.605099
C 0.837320 0.035386 0.141613
C -0.314873 0.276306 -0.867436
C -1.559842 -0.509787 -0.560456
C 1.874059 1.149784 0.030722
C 1.512069 -1.326547 0.008239
C -2.617157 0.050525 0.186773
C -2.524240 1.447472 0.756436
C -1.675941 -1.826203 -1.034763
C 2.078881 2.032093 1.099899
C 1.714622 -1.927575 -1.241132
C 2.622068 1.299594 -1.146150
C 1.974293 -1.970076 1.165759
C -3.765538 -0.716652 0.440120
C -2.822236 -2.579466 -0.777440
C -3.871356 -2.022409 -0.039466
C 3.021182 3.058732 0.991217
C 2.356650 -3.166435 -1.329647
C 3.562230 2.327949 -1.251236
C 2.613690 -3.208687 1.075593
C 3.762874 3.209776 -0.184124
C 2.804418 -3.810604 -0.172465
C -4.105766 2.475763 -0.831460
C -3.799444 3.441412 1.400510
H 0.033649 0.062630 -1.897490
H -0.552288 1.367670 -0.864000
H -2.293970 1.365065 1.845494
H -1.663685 2.001319 0.307852
H -0.860827 -2.270101 -1.605109
H -0.414198 -0.496074 1.622310
H 1.500006 1.908844 2.019270
H 1.373804 -1.434323 -2.150688
H 2.483027 0.611767 -1.977979
H 1.836771 -1.490085 2.137624
H -4.584563 -0.271938 1.011472
H -2.897975 -3.598925 -1.150234
H -4.767969 -2.605301 0.161534
H 3.177703 3.739752 1.825843
H 2.509309 -3.628896 -2.303061
H 4.142151 2.439893 -2.165442
H 2.967171 -3.703279 1.978821
H 4.496505 4.008938 -0.267967
H 3.302762 -4.775404 -0.242660
H -4.136730 1.527612 -1.394626
H -3.377433 3.140541 -1.316856
H -5.103976 2.933865 -0.912930
H -4.775441 3.944023 1.305073
H -3.015030 4.155879 1.111843
H -3.669042 3.192903 2.465976


%chk=000254049-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000254049

0 1
O 0.281626 0.093659 1.439615
N -3.803858 2.217702 0.771512
C 0.904902 -0.035173 0.101854
C -0.211306 0.216031 -0.993376
C -1.535549 -0.488617 -0.713212
C 1.939345 1.107128 0.015233
C 1.577242 -1.424487 -0.005026
C -2.595903 0.140265 0.016188
C -2.489011 1.570432 0.560395
C -1.724368 -1.819610 -1.177387
C 1.742237 2.290595 0.771624
C 1.816894 -2.079992 -1.240227
C 3.047965 1.033934 -0.863453
C 2.031177 -2.050159 1.185321
C -3.786613 -0.589730 0.268605
C -2.913971 -2.532612 -0.922606
C -3.951267 -1.913094 -0.188888
C 2.636522 3.376674 0.649710
C 2.475624 -3.329699 -1.284251
C 3.937947 2.124252 -0.991477
C 2.688701 -3.298623 1.144903
C 3.735693 3.301952 -0.236918
C 2.912590 -3.947425 -0.091283
C -4.462008 2.594344 -0.496776
C -3.728004 3.349523 1.715445
H 0.180245 -0.087931 -1.979535
H -0.358486 1.307999 -1.040788
H -1.963523 1.543645 1.534556
H -1.840283 2.188801 -0.109290
H -0.918740 -2.302586 -1.740848
H -0.478742 -0.545719 1.470574
H 0.901708 2.335441 1.469711
H 1.495719 -1.623968 -2.183683
H 3.234612 0.118847 -1.434589
H 1.862729 -1.541237 2.139332
H -4.577712 -0.078038 0.827872
H -3.029513 -3.557577 -1.292361
H -4.880876 -2.454419 0.021012
H 2.477151 4.280629 1.249017
H 2.646531 -3.818025 -2.250526
H 4.792694 2.049010 -1.673354
H 3.028916 -3.763282 2.077416
H 4.428893 4.145442 -0.331907
H 3.421518 -4.917264 -0.124575
H -4.554764 1.708189 -1.147572
H -3.900157 3.381498 -1.061360
H -5.477208 2.977756 -0.290334
H -4.742784 3.747232 1.897041
H -3.091005 4.194527 1.348560
H -3.317032 3.005660 2.681405


