%chk=000249425.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249425

0 1
O 2.078464 -1.314460 0.043804
O -2.078521 1.314407 0.043830
O 9.123375 -1.147876 -0.463959
O -9.123348 1.148100 -0.464060
N 2.991229 0.776958 -0.280103
N -2.991291 -0.776990 -0.280167
N 5.203517 1.522661 -0.326098
N -5.203598 -1.522633 -0.326315
N 9.308809 0.765775 0.732235
N -9.308938 -0.765746 0.731796
C 0.553169 0.527784 -0.316281
C -0.553226 -0.527834 -0.316277
C 1.908737 -0.131620 -0.164471
C -1.908794 0.131571 -0.164466
C 4.367443 0.435222 -0.183995
C -4.367499 -0.435227 -0.184104
C 4.849012 -0.873122 0.027856
C -4.849037 0.873117 0.027810
C 7.091363 0.039391 -0.017382
C -7.091414 -0.039329 -0.017577
C 6.225799 -1.061785 0.101713
C -6.225822 1.061815 0.101623
C 6.536446 1.312588 -0.247509
C -6.536524 -1.312527 -0.247767
C 8.559982 -0.194562 0.045234
C -8.560025 0.194674 0.045002
H 0.498178 1.136841 -1.245461
H 0.379443 1.258417 0.510841
H -0.379500 -1.258465 0.510846
H -0.498232 -1.136900 -1.245453
H 2.803324 1.776224 -0.448144
H -2.803397 -1.776251 -0.448249
H 4.155449 -1.716414 0.123915
H -4.155451 1.716380 0.123948
H 6.641572 -2.064641 0.247448
H -6.641572 2.064673 0.247406
H 7.167956 2.201158 -0.386493
H -7.168051 -2.201069 -0.386840
H 8.895456 1.476414 1.306864
H 10.302596 0.624980 0.843607
H -8.895653 -1.476485 1.306351
H -10.302723 -0.624915 0.843139


%chk=000249425-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249425

0 1
O 2.006140 -1.280208 0.632724
O -2.007402 1.282631 0.631778
O 9.129898 -1.309308 0.565632
O -9.131076 1.305892 0.566334
N 3.029086 0.586516 -0.348686
N -3.028924 -0.584118 -0.350977
N 5.209603 1.281362 -0.676492
N -5.208936 -1.281162 -0.677522
N 9.453897 0.914667 0.004256
N -9.453244 -0.918458 0.005392
C 0.577521 0.508505 -0.274075
C -0.577442 -0.504975 -0.275034
C 1.917450 -0.162648 0.043896
C -1.917835 0.166174 0.040995
C 4.399906 0.303997 -0.162610
C -4.399923 -0.302948 -0.164179
C 4.899472 -0.863031 0.477552
C -4.900289 0.863692 0.476061
C 7.157018 0.014672 0.089023
C -7.157184 -0.016238 0.088796
C 6.293378 -0.993932 0.592439
C -6.294261 0.993262 0.591645
C 6.552873 1.127821 -0.548605
C -6.552290 -1.128887 -0.548996
C 8.640981 -0.184341 0.237078
C -8.641263 0.181379 0.237559
H 0.630403 1.055409 -1.234211
H 0.362590 1.268411 0.505137
H -0.363631 -1.265046 0.504333
H -0.628927 -1.051677 -1.235356
H 2.874284 1.480240 -0.827749
H -2.873483 -1.477805 -0.829900
H 4.204524 -1.613390 0.855889
H -4.205874 1.614802 0.853891
H 6.744135 -1.872131 1.065327
H -6.745625 1.871100 1.064624
H 7.148726 1.927552 -1.005461
H -7.147602 -1.929249 -1.005452
H 9.093691 1.850053 -0.170386
H 10.461037 0.781378 0.088508
H -9.092232 -1.853524 -0.169301
H -10.460464 -0.786137 0.090220


