%chk=000249258.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249258

0 1
O 0.232813 -0.001703 2.012439
O 0.649524 2.916787 -1.325958
N -0.074868 1.027024 -0.138813
N -2.228286 0.411032 0.626838
C 0.566171 -0.110518 0.646611
C 2.055080 0.227357 0.536208
C 2.228519 1.403420 -0.230759
C 0.222694 -1.474551 0.072725
C 0.907007 1.943611 -0.661768
C -1.483649 1.193521 -0.224497
C 3.140349 -0.445415 1.066282
C 3.491132 1.916942 -0.480595
C 0.118578 -1.674141 -1.309641
C 0.050407 -2.553390 0.951338
C 4.425617 0.075255 0.814005
C 4.598989 1.232060 0.053725
C -2.075451 2.096590 -1.133501
C -0.163437 -2.949233 -1.809196
C -0.230824 -3.825614 0.447524
C -0.338781 -4.024725 -0.932937
C -3.586962 0.496518 0.563188
C -3.466634 2.170584 -1.172383
C -4.239779 1.367288 -0.330797
C -4.357651 -0.374601 1.499439
H 3.007641 -1.344951 1.665698
H 3.620093 2.824835 -1.070903
H -0.759274 -0.084474 2.143629
H 0.252033 -0.839871 -1.998552
H 0.136556 -2.393495 2.027867
H 5.295824 -0.438609 1.224671
H 5.602186 1.616746 -0.129102
H -1.457230 2.726500 -1.778247
H -0.247724 -3.102490 -2.883894
H -0.366567 -4.661915 1.130977
H -0.559268 -5.016299 -1.324688
H -3.951650 2.859533 -1.866263
H -5.323381 1.414225 -0.358608
H -5.092496 -0.989028 0.959847
H -3.706877 -1.065143 2.059331
H -4.904826 0.227838 2.239362


%chk=000249258-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249258

0 1
O 0.013135 -0.010945 1.992945
O 0.696481 2.838845 -1.549483
N -0.092575 1.002853 -0.228358
N -2.204369 0.483743 0.647962
C 0.496604 -0.100392 0.633086
C 1.982024 0.246493 0.585745
C 2.199789 1.357702 -0.254855
C 0.207197 -1.487456 0.012428
C 0.901795 1.859972 -0.780341
C -1.490576 1.183232 -0.290866
C 3.053351 -0.390283 1.229590
C 3.490774 1.870665 -0.484824
C 0.160996 -1.678896 -1.389800
C 0.058050 -2.602638 0.871286
C 4.356791 0.121213 1.012525
C 4.575986 1.237024 0.161574
C -2.115909 2.032230 -1.242582
C -0.045879 -2.968538 -1.925904
C -0.146315 -3.893474 0.334058
C -0.199801 -4.081157 -1.066094
C -3.569044 0.564029 0.664131
C -3.519795 2.121506 -1.210735
C -4.262039 1.379738 -0.261058
C -4.279652 -0.251189 1.721457
H 2.886167 -1.250372 1.884819
H 3.631665 2.736394 -1.139789
H -1.003940 0.011331 1.852639
H 0.278022 -0.822943 -2.064138
H 0.091195 -2.440020 1.953462
H 5.211779 -0.351634 1.508501
H 5.595336 1.608145 0.009944
H -1.507126 2.591203 -1.954321
H -0.087039 -3.105625 -3.012359
H -0.265333 -4.750430 1.006886
H -0.359950 -5.081651 -1.483492
H -4.035795 2.764302 -1.931712
H -5.353873 1.432946 -0.230991
H -5.373786 -0.143094 1.644557
H -4.021665 -1.320818 1.621371
H -3.967072 0.065489 2.733341


