%chk=000230504.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230504

0 1
O -1.477941 -2.759850 -1.351404
O 4.821968 -0.458235 0.392728
O -1.579846 -2.638625 1.567512
O 3.232486 -2.099514 -1.339176
O -1.831266 3.546214 0.890163
N -1.907088 3.124451 -1.374861
N 0.187716 3.394330 -0.257458
C -3.757957 1.466495 -1.738801
C 0.972279 2.104588 1.774090
C -3.371253 2.905677 -1.355955
C 0.949885 3.445972 1.016193
C -3.154434 0.410310 -0.854144
C 1.554584 0.994059 0.947799
C -2.587759 -0.729805 -1.436379
C 2.929318 0.718614 0.996326
C -3.177609 0.542235 0.544220
C 0.725216 0.234353 0.115400
C -1.230826 3.322756 -0.153290
C -2.032961 -1.732316 -0.622230
C 3.466549 -0.313759 0.216418
C -2.068232 -1.596844 0.784249
C 2.614568 -1.081976 -0.624978
C -2.647158 -0.458158 1.357308
C 1.249657 -0.801393 -0.665888
C -1.016504 -3.931798 -0.629818
C 5.511911 -1.461598 -0.394680
C -0.555282 -2.239826 2.517925
C 2.456826 -2.723316 -2.391728
H -3.496999 1.280297 -2.801009
H -4.866389 1.371809 -1.695483
H -0.065008 1.852306 2.091101
H 1.538053 2.231482 2.719135
H -3.834482 3.621813 -2.073162
H -3.767407 3.165125 -0.341848
H 1.983901 3.773882 0.768709
H 0.493387 4.229074 1.668490
H -1.416698 2.810147 -2.203459
H 0.642084 2.832442 -0.979323
H -2.562773 -0.864675 -2.515701
H 3.598701 1.296123 1.632108
H -3.597018 1.440022 1.002280
H -0.346024 0.437714 0.076696
H -2.679108 -0.359755 2.441903
H 0.573650 -1.385831 -1.293687
H -1.811732 -4.319706 0.017920
H -0.133327 -3.674198 -0.036689
H -0.785627 -4.624814 -1.445028
H 5.409328 -1.238152 -1.461160
H 5.116815 -2.457020 -0.163148
H 6.545721 -1.344817 -0.051258
H -0.996333 -1.628598 3.309068
H 0.254111 -1.708258 2.005724
H -0.216844 -3.205116 2.909878
H 1.590541 -3.243625 -1.971445
H 3.179754 -3.433881 -2.810276
H 2.156476 -1.980329 -3.136076


%chk=000230504-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230504

0 1
O -1.301735 -2.794678 -1.569315
O 5.180616 -0.265459 0.161619
O -1.403169 -2.899690 1.244093
O 3.372074 -2.243386 -0.836875
O -1.620269 3.847635 0.876740
N -1.841624 3.021322 -1.307889
N 0.294506 3.398748 -0.400712
C -3.805858 1.488735 -1.668462
C 1.423827 2.573009 1.716072
C -3.299038 2.892659 -1.238171
C 1.211993 3.735947 0.696473
C -3.208933 0.334772 -0.871879
C 1.924225 1.294885 1.063733
C -2.579197 -0.748304 -1.533688
C 3.308362 1.059201 0.864657
C -3.263846 0.304500 0.542408
C 1.010598 0.326259 0.580682
C -1.088403 3.441880 -0.207057
C -2.005307 -1.821756 -0.823392
C 3.782268 -0.102083 0.217868
C -2.049697 -1.828046 0.602618
C 2.845152 -1.077991 -0.246514
C -2.696550 -0.762747 1.272626
C 1.462010 -0.845885 -0.067363
C -1.734917 -4.198526 -1.394819
C 5.778278 -0.601568 -1.145931
C -1.274513 -2.829610 2.703908
C 2.411224 -3.285647 -1.219996
H -3.596732 1.337554 -2.746122
H -4.910920 1.497446 -1.569058
H 0.455734 2.396660 2.219146
H 2.138907 2.926720 2.484050
H -3.793684 3.658731 -1.870729
H -3.571844 3.114538 -0.192051
H 2.180923 4.031069 0.252828
H 0.790664 4.605408 1.229385
H -1.372521 2.777381 -2.181041
H 0.669656 2.822325 -1.156313
H -2.508383 -0.775565 -2.627066
H 4.059734 1.773540 1.220660
H -3.731450 1.129826 1.090682
H -0.065939 0.476994 0.720457
H -2.741298 -0.743933 2.365658
H 0.729969 -1.579774 -0.416174
H -2.798559 -4.308083 -1.681487
H -1.586759 -4.528668 -0.353171
H -1.102656 -4.782377 -2.081742
H 5.554517 0.190676 -1.887689
H 5.410262 -1.573558 -1.512525
H 6.862701 -0.640649 -0.959636
H -2.264350 -2.875781 3.197738
H -0.743241 -1.908748 3.009877
H -0.679905 -3.712172 2.981896
H 1.838499 -3.639881 -0.341617
H 3.026472 -4.103018 -1.625168
H 1.701730 -2.924336 -1.988426


