%chk=000209856.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209856

0 1
O -0.665133 -2.456207 1.215639
N 1.507789 0.287589 1.287114
N -2.026647 -0.662859 -0.490331
N -1.169884 -0.288818 0.543919
C 1.916123 1.471782 2.116013
C 2.694701 -0.356111 0.630961
C 2.209308 2.659586 1.183677
C 2.239467 -1.333688 -0.462170
C 0.720496 -0.690895 2.095286
C 2.559501 3.918013 1.987833
C 3.421590 -1.784423 -1.329413
C -0.391848 -1.275577 1.216864
C 2.857262 5.102465 1.071835
C 2.976466 -2.770318 -2.406650
C -1.767926 -0.483152 -1.877991
C -3.250384 -1.355060 -0.315508
C -2.864285 -1.007011 -2.550156
C -3.776144 -1.546935 -1.588829
C -0.553064 0.181938 -2.386967
C -3.758272 -1.761910 1.008215
H 1.078045 1.739804 2.796957
H 2.794047 1.261497 2.763355
H 3.303221 0.457185 0.171040
H 3.357529 -0.874791 1.356513
H 3.036320 2.408171 0.490318
H 1.331701 2.850735 0.534967
H 1.744652 -2.219513 -0.015040
H 1.460865 -0.852335 -1.102605
H 1.324012 -1.539838 2.492092
H 0.250951 -0.210141 2.982820
H 3.434119 3.721777 2.638914
H 1.725458 4.176496 2.670019
H 4.199360 -2.253385 -0.694782
H 3.903360 -0.906814 -1.803256
H -0.717495 0.629844 0.372004
H 1.997864 5.350331 0.437853
H 3.103993 5.999283 1.651959
H 3.705349 4.899213 0.407914
H 2.231061 -2.329272 -3.078748
H 3.822324 -3.096455 -3.021801
H 2.522982 -3.668934 -1.969839
H -3.014141 -1.013502 -3.610160
H -4.706534 -2.021307 -1.822209
H -0.572440 1.266938 -2.211266
H 0.371253 -0.220693 -1.920903
H -0.451596 0.032915 -3.472614
H -3.066910 -2.483744 1.483621
H -3.862365 -0.907536 1.691875
H -4.739301 -2.249837 0.929159


%chk=000209856-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209856

0 1
O -1.178524 -2.495701 1.522057
N 1.704981 -0.291787 0.817579
N -2.096086 -0.595259 -0.465232
N -0.795210 -0.723915 0.014867
C 1.507804 0.793223 1.828737
C 3.124186 -0.437955 0.379319
C 1.553147 2.211832 1.225502
C 3.266617 -1.081450 -1.015130
C 1.097540 -1.572225 1.267108
C 1.332979 3.307926 2.294143
C 4.745117 -1.251886 -1.435165
C -0.417384 -1.653567 0.975363
C 1.372918 4.733125 1.702426
C 4.896669 -1.895286 -2.830209
C -2.667257 -1.413203 -1.464071
C -3.020691 0.374315 -0.016724
C -3.967265 -0.938587 -1.658039
C -4.186069 0.172642 -0.761181
C -1.914819 -2.555555 -2.079703
C -2.686867 1.350422 1.072872
H 0.513185 0.641772 2.290435
H 2.257533 0.708991 2.653269
H 3.572732 0.571697 0.347597
H 3.714643 -1.024305 1.125993
H 2.524050 2.388271 0.720785
H 0.772942 2.293345 0.441810
H 2.770981 -2.073419 -1.034084
H 2.734767 -0.450153 -1.753890
H 1.569827 -2.415127 0.730146
H 1.232222 -1.767409 2.353628
H 2.106717 3.211922 3.083036
H 0.356548 3.141226 2.793462
H 5.271768 -1.873071 -0.681957
H 5.245327 -0.261839 -1.426627
H -0.035587 -0.108069 -0.322735
H 0.590754 4.865568 0.931521
H 1.209857 5.498265 2.483020
H 2.350412 4.938679 1.226796
H 4.401608 -1.282200 -3.606455
H 5.960033 -2.002653 -3.111649
H 4.437681 -2.901432 -2.854754
H -4.685685 -1.355921 -2.362244
H -5.099764 0.757227 -0.661831
H -0.967118 -2.230948 -2.552206
H -1.666933 -3.329788 -1.328485
H -2.536377 -3.026786 -2.858713
H -2.445551 0.838487 2.024788
H -1.826063 2.000629 0.816781
H -3.555495 2.004430 1.255541


