%chk=000207561.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207561

0 1
O -5.368422 -0.972278 -0.668751
N 0.124095 -1.670550 0.075775
N 2.696902 -0.375573 -0.097525
N -3.605094 -2.038709 0.291140
N 5.062795 -0.622799 -0.150316
N -1.351730 4.002473 0.222016
C 0.232422 -0.176656 -0.011104
C 1.248698 -2.299397 -0.691800
C 1.561193 0.273852 0.624681
C 2.596140 -1.867271 -0.079726
C -1.206897 -2.139177 -0.426445
C -2.200872 -2.056969 0.757371
C 3.972214 0.211678 0.003376
C 4.131757 1.619230 0.143125
C -4.269074 -3.353691 0.131793
C -4.244629 -0.892058 -0.194246
C 5.413071 2.154771 0.095108
C -3.497227 0.397933 -0.074762
C 6.295111 -0.062012 -0.198926
C 6.521268 1.316306 -0.078943
C -2.922214 0.965316 -1.220532
C -3.418221 1.064743 1.155755
C -2.236395 2.173854 -1.138478
C -2.738557 2.275006 1.256951
C -2.133460 2.832870 0.107523
H -0.615198 0.276639 0.551662
H 0.164731 0.203725 -1.054372
H 1.229534 -2.045368 -1.774134
H 1.156793 -3.403945 -0.607631
H 1.646863 1.381421 0.549988
H 1.575020 0.007835 1.706198
H 2.695719 -2.261043 0.956061
H 3.431537 -2.302203 -0.677598
H -1.582255 -1.554181 -1.293199
H -1.134489 -3.190605 -0.774969
H -2.044788 -2.920100 1.441226
H -1.999021 -1.149205 1.371676
H 3.264692 2.261428 0.265994
H -3.709062 -4.006581 -0.554998
H -5.289782 -3.216847 -0.281450
H -4.365081 -3.853918 1.108703
H 5.556229 3.231303 0.193723
H 7.126136 -0.765939 -0.331228
H 7.526279 1.719333 -0.117954
H -3.019117 0.459725 -2.183483
H -3.895315 0.633536 2.038227
H -1.786293 2.605408 -2.028353
H -2.674970 2.784657 2.214441
H -1.538273 4.599625 1.014920
H -1.191064 4.528007 -0.625510


%chk=000207561-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207561

0 1
O -4.978918 -1.234263 -1.482175
N 0.486578 -1.593885 0.217572
N 3.215321 -0.669792 0.341597
N -3.317545 -1.807641 0.042318
N 5.447459 -1.258263 -0.122748
N -3.806675 4.773405 0.518240
C 0.824573 -0.183017 -0.088139
C 1.605978 -2.482103 -0.191194
C 2.108286 0.248423 0.651698
C 2.891908 -2.095851 0.558211
C -0.828852 -2.002890 -0.326009
C -1.979095 -1.532271 0.605866
C 4.529183 -0.258331 0.112781
C 4.927228 1.120625 0.108481
C -3.662476 -3.228801 -0.159014
C -4.103488 -0.861093 -0.630497
C 6.267315 1.440768 -0.169173
C -3.937567 0.593276 -0.293523
C 6.736905 -0.916759 -0.384484
C 7.207971 0.412679 -0.429283
C -4.090023 1.546352 -1.335128
C -3.776607 1.075193 1.033617
C -4.035364 2.925615 -1.077736
C -3.741113 2.453582 1.310360
C -3.855926 3.405742 0.254385
H -0.004833 0.474293 0.229630
H 0.974169 -0.034493 -1.188243
H 1.794509 -2.428682 -1.292884
H 1.341528 -3.525177 0.062507
H 2.359158 1.274086 0.339526
H 1.908756 0.255334 1.745288
H 2.739769 -2.279159 1.643697
H 3.752574 -2.688911 0.214009
H -1.007911 -1.602305 -1.354881
H -0.840991 -3.105909 -0.400322
H -1.868518 -2.038858 1.583899
H -1.879393 -0.451046 0.776799
H 4.218830 1.923004 0.328372
H -3.201811 -3.651280 -1.073585
H -4.753680 -3.319572 -0.271476
H -3.322240 -3.808800 0.717686
H 6.579453 2.491315 -0.173979
H 7.416872 -1.758848 -0.563657
H 8.257242 0.630375 -0.646085
H -4.269817 1.180660 -2.351639
H -3.722628 0.364325 1.866506
H -4.145431 3.641747 -1.901408
H -3.638760 2.800751 2.345937
H -3.709033 5.118476 1.468603
H -3.921172 5.451574 -0.229323


