%chk=000236830.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236830

0 1
O 0.074096 -3.007268 1.408994
O 3.457145 -0.400532 -0.119571
N 1.747772 -1.712922 0.572002
N -1.141260 -1.859539 -2.296926
N 2.234619 2.892466 -0.446392
C -0.156044 0.421393 0.201227
C -1.133822 1.357639 -0.543858
C -0.627029 -1.067207 0.135877
C 1.232894 0.483177 -0.545147
C -2.591922 1.532706 -0.053596
C 0.033167 0.825066 1.662332
C 0.378592 -2.027867 0.773459
C 2.260748 -0.526183 -0.027596
C -3.413454 0.241824 -0.069319
C -2.697256 2.224312 1.308312
C -0.906626 -1.512550 -1.220864
C 1.800923 1.823405 -0.485530
H -0.685415 2.376765 -0.560025
H -1.184015 1.050394 -1.610335
H -1.596702 -1.142172 0.736843
H 1.063746 0.224680 -1.636569
H -3.062794 2.226310 -0.807544
H -0.905974 0.731258 2.233550
H 0.792321 0.235909 2.188021
H 0.336748 1.878682 1.753395
H 2.445302 -2.388257 0.931418
H -3.063432 -0.487909 0.675006
H -3.394738 -0.241124 -1.053702
H -4.466859 0.445660 0.163136
H -2.365382 1.575138 2.130080
H -3.734086 2.509269 1.524843
H -2.096167 3.139679 1.346978


%chk=000236830-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236830

0 1
O 0.196141 -3.236930 1.159677
O 3.544555 -0.260415 -0.001495
N 1.830173 -1.740439 0.467789
N -0.894903 -1.841409 -2.564513
N 2.136552 3.003332 -0.210414
C -0.181217 0.327725 0.204741
C -1.174393 1.272666 -0.553689
C -0.557614 -1.191942 0.003631
C 1.240249 0.507546 -0.473313
C -2.628443 1.543555 -0.042221
C -0.088803 0.627323 1.721521
C 0.493840 -2.154374 0.605006
C 2.315323 -0.494947 0.013436
C -3.472806 0.285657 0.279798
C -2.708630 2.575866 1.112720
C -0.747838 -1.549751 -1.416771
C 1.753121 1.881503 -0.329626
H -0.681728 2.262549 -0.626009
H -1.249382 0.895105 -1.594513
H -1.498264 -1.410436 0.535777
H 1.117005 0.313496 -1.562706
H -3.115115 2.028215 -0.915498
H -1.036525 0.384856 2.229574
H 0.711751 0.045873 2.214190
H 0.123076 1.696716 1.887877
H 2.547064 -2.398690 0.801236
H -3.145411 -0.206208 1.216052
H -3.442684 -0.454464 -0.541455
H -4.530371 0.571109 0.426909
H -2.351413 2.165762 2.072927
H -3.756831 2.894954 1.261976
H -2.111383 3.478401 0.885885


