%chk=000289941.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289941

0 1
O 1.613563 2.459449 1.314773
O -1.089158 0.224772 -2.633922
N 1.803493 0.237735 0.712071
N -1.661786 0.817201 -0.506529
N -1.251405 1.715124 0.525077
C -0.450846 -0.555683 1.085170
C -0.346627 0.957870 1.451722
C 0.961049 -0.983498 0.615687
C -1.504536 -0.615068 -0.052881
C 3.206931 0.270996 0.220740
C 1.112321 1.368785 1.151512
C 4.066459 -0.768759 0.969016
C 3.262303 0.041512 -1.304125
C 5.518039 -0.695908 0.476469
C 4.715485 0.107357 -1.791038
C -2.857291 -1.135839 0.383034
C 5.603716 -0.896877 -1.043131
C -1.192859 1.138635 -1.836222
C -3.559987 -1.983311 -0.487716
C -3.428797 -0.780595 1.613092
C -0.998081 2.581277 -2.156329
C -4.812737 -2.482344 -0.122178
C -4.682556 -1.282447 1.974735
C -5.375122 -2.135805 1.110613
H -0.764062 -1.167264 1.954860
H -0.572264 1.170640 2.518442
H 1.375225 -1.781105 1.267632
H 0.957262 -1.376006 -0.424604
H -1.126934 -1.231631 -0.917706
H 3.596562 1.304473 0.450675
H -2.104651 2.016826 1.031610
H 3.669466 -1.788450 0.812712
H 4.022266 -0.582554 2.058425
H 2.649632 0.801895 -1.824852
H 2.820556 -0.936886 -1.569233
H 6.126760 -1.461012 0.993796
H 5.960220 0.281665 0.751698
H 5.111261 1.133043 -1.656319
H 4.753142 -0.091873 -2.878788
H 6.652788 -0.793228 -1.377844
H 5.300565 -1.929433 -1.302110
H -3.135394 -2.244031 -1.458088
H -2.906138 -0.110243 2.290776
H -1.930766 3.153845 -2.039182
H -0.647224 2.711880 -3.189900
H -0.264576 3.054580 -1.477593
H -5.353437 -3.139429 -0.802188
H -5.121770 -1.004490 2.931540
H -6.350958 -2.525690 1.394102


%chk=000289941-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289941

0 1
O 1.628900 2.306921 1.497050
O -1.592006 0.023057 -2.888541
N 1.821738 0.159667 0.531706
N -1.580434 0.615436 -0.655599
N -1.261331 1.529017 0.406110
C -0.395527 -0.734564 0.863534
C -0.334927 0.768301 1.317126
C 0.988546 -1.008955 0.192397
C -1.574252 -0.797293 -0.148733
C 3.260279 0.254840 0.203941
C 1.135774 1.199420 1.139443
C 4.107645 -0.753130 1.023014
C 3.525119 0.101162 -1.315712
C 5.613818 -0.584703 0.707158
C 5.031741 0.273100 -1.625959
C -2.936050 -1.179083 0.427109
C 5.892689 -0.719976 -0.809029
C -1.464449 0.934783 -2.011428
C -3.905262 -1.749066 -0.438838
C -3.290231 -0.933217 1.778776
C -1.242720 2.400197 -2.342636
C -5.195346 -2.069840 0.034349
C -4.583277 -1.250725 2.254549
C -5.539539 -1.820825 1.384459
H -0.551874 -1.414429 1.715038
H -0.632345 0.944074 2.365260
H 1.446501 -1.940867 0.571649
H 0.883260 -1.106702 -0.905767
H -1.349492 -1.440353 -1.016254
H 3.547469 1.281248 0.510129
H -2.129690 1.790467 0.902285
H 3.799944 -1.790784 0.776095
H 3.918828 -0.600166 2.102411
H 2.925280 0.844948 -1.873793
H 3.201573 -0.904768 -1.655076
H 6.202040 -1.330917 1.274982
H 5.947743 0.415548 1.051567
H 5.339468 1.310572 -1.381897
H 5.208240 0.134153 -2.709707
H 6.967122 -0.551331 -1.014898
H 5.662338 -1.756278 -1.133303
H -3.643192 -1.925060 -1.489070
H -2.557722 -0.505869 2.474303
H -2.205789 2.943297 -2.319175
H -0.832272 2.468798 -3.361534
H -0.575396 2.880790 -1.609369
H -5.931282 -2.512693 -0.645903
H -4.842058 -1.057566 3.301798
H -6.540490 -2.070534 1.753483


