%chk=000248114.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248114

0 1
O -3.269875 -0.602821 -2.517568
O -6.697257 -1.130157 0.536922
N -4.685288 -0.400562 1.380230
N -4.979300 -0.872460 -0.996378
N -1.518584 0.327103 -0.142155
N -2.385927 0.373421 2.002693
N -0.073514 1.170916 1.696129
N 7.038157 -0.208642 -1.310135
N 1.058958 0.735225 1.018570
C -2.858884 -0.102565 -0.215655
C -3.367081 -0.048674 1.112588
C -3.626450 -0.522597 -1.360090
C -5.540738 -0.826845 0.311738
C -1.271593 0.593801 1.200292
C -5.211230 -0.338148 2.765288
C -5.892730 -1.342376 -2.074950
C 5.842724 -0.010544 -0.577497
C 3.448767 0.645211 0.788544
C 5.880018 0.546899 0.727092
C 4.578948 -0.240022 -1.176507
C 4.703259 0.871010 1.388094
C 3.408853 0.088140 -0.503388
C 2.232647 0.998769 1.530918
C 8.298922 -0.362721 -0.535929
C 6.981919 -1.128220 -2.477945
H -0.874206 0.367723 -0.916308
H -6.278746 -0.631395 2.780154
H -5.115453 0.687718 3.163766
H -4.642496 -1.021199 3.420944
H -5.488789 -1.048607 -3.062269
H -6.897359 -0.900696 -1.950281
H -5.988563 -2.440917 -2.045683
H -0.054707 1.245388 2.729739
H 6.833293 0.739129 1.214445
H 4.512070 -0.663518 -2.176431
H 4.757577 1.304492 2.387690
H 2.443155 -0.091459 -0.982771
H 2.403376 1.481893 2.507706
H 8.335060 -1.284457 0.066270
H 8.431668 0.503055 0.137463
H 9.158392 -0.362602 -1.227050
H 6.790170 -2.177632 -2.203001
H 7.933936 -1.079960 -3.032370
H 6.190698 -0.797201 -3.174813


%chk=000248114-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248114

0 1
O -3.215657 -1.269900 -2.371650
O -6.949567 -0.521190 0.427867
N -4.825269 -0.070497 1.320385
N -5.080433 -0.884410 -0.940630
N -1.508516 -0.305349 0.055031
N -2.486368 0.328170 2.028594
N -0.073034 0.421640 1.860284
N 7.157247 -0.226619 -1.267104
N 1.037903 0.210294 1.056854
C -2.898140 -0.454436 -0.115707
C -3.455845 -0.057769 1.110449
C -3.662901 -0.899408 -1.240255
C -5.692578 -0.493002 0.279602
C -1.319574 0.159199 1.338936
C -5.390339 0.351742 2.615118
C -6.009612 -1.319861 -2.007036
C 5.955243 -0.060408 -0.579728
C 3.463651 0.279939 0.833418
C 5.929560 0.399784 0.777387
C 4.694329 -0.344373 -1.208142
C 4.712459 0.562606 1.456096
C 3.489191 -0.177623 -0.517289
C 2.226230 0.462440 1.581102
C 8.432960 0.068980 -0.600847
C 7.154828 -0.700469 -2.658650
H -0.772905 -0.497610 -0.622975
H -6.484276 0.266105 2.542317
H -5.102308 1.394199 2.832201
H -5.010115 -0.294405 3.424360
H -5.397845 -1.576298 -2.884609
H -6.716116 -0.509027 -2.249171
H -6.591022 -2.194528 -1.671521
H -0.018581 0.761386 2.828810
H 6.861421 0.630027 1.300565
H 4.663380 -0.696460 -2.242816
H 4.727484 0.916404 2.495301
H 2.539958 -0.400162 -1.015573
H 2.325873 0.827122 2.623158
H 8.587714 -0.570322 0.291817
H 8.491392 1.128044 -0.277584
H 9.263478 -0.117940 -1.299114
H 6.693790 -1.704364 -2.750575
H 8.191551 -0.770412 -3.022773
H 6.605153 -0.008340 -3.327804


