%chk=000290831.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290831

0 1
O 2.778466 0.993918 -0.350500
O -2.653224 2.023662 1.574908
O 0.619680 -0.837959 0.771156
O -0.524620 -0.397944 -1.007884
N -5.417682 -1.193209 -0.497689
N -2.656281 1.368452 -0.623917
N 0.161209 -0.070039 -0.054126
C -4.011228 -0.705388 -0.350553
C -4.035027 0.823431 -0.578083
C -5.479235 -2.559098 -1.094680
C -6.170685 -1.083259 0.795818
C -4.806648 -3.678909 -0.296261
C -7.676413 -1.116445 0.530099
C -0.610938 2.281936 0.357784
C -2.054551 1.858287 0.526003
C 0.437267 1.378696 0.115050
C 1.759115 1.851203 0.013408
C 2.047723 3.231281 0.142380
C -0.324282 3.640789 0.505959
C 0.989268 4.110464 0.391337
C 3.446731 3.722783 0.010038
C 3.396011 0.249684 0.766414
C 4.097007 -0.889013 0.086098
C 3.420704 -2.101585 -0.116225
C 5.421975 -0.744083 -0.350573
C 4.073834 -3.166973 -0.740852
C 6.070273 -1.813840 -0.974115
C 5.398352 -3.025205 -1.168061
H -3.355838 -1.187670 -1.108893
H -3.559820 -0.940210 0.636810
H -4.610606 1.330371 0.231854
H -4.544668 1.065425 -1.537774
H -6.554615 -2.802214 -1.250816
H -5.027796 -2.495104 -2.110361
H -5.893189 -1.877619 1.522450
H -5.905403 -0.112445 1.272937
H -2.090896 1.099634 -1.433857
H -3.731647 -3.506703 -0.173620
H -5.237811 -3.777570 0.706463
H -4.925479 -4.644767 -0.798963
H -7.950196 -0.413152 -0.267848
H -8.015642 -2.109329 0.215459
H -8.237728 -0.839399 1.428356
H -1.136848 4.341524 0.720960
H 1.188668 5.178777 0.502109
H 3.868609 4.003096 0.986172
H 4.108621 2.955731 -0.428822
H 3.511464 4.606116 -0.641700
H 4.077975 0.953057 1.273189
H 2.605520 -0.086994 1.465081
H 2.382302 -2.208881 0.209790
H 5.944025 0.200563 -0.211075
H 3.547946 -4.107764 -0.897614
H 7.098978 -1.702179 -1.312229
H 5.905272 -3.857033 -1.654388


%chk=000290831-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000290831

0 1
O 2.823552 0.866505 -0.469813
O -2.958739 2.073532 1.000719
O 0.847391 -1.119354 0.076038
O -0.305989 -0.434553 -1.758682
N -5.726918 -1.239975 -0.367999
N -2.625634 0.876236 -0.965504
N 0.310166 -0.197871 -0.643068
C -4.287530 -0.908136 -0.354815
C -4.030953 0.453113 -1.063629
C -6.042392 -2.655825 -0.673088
C -6.478526 -0.633512 0.759714
C -5.668494 -3.691841 0.423201
C -7.996386 -0.557533 0.510034
C -0.701678 2.003947 0.135425
C -2.177792 1.624360 0.098961
C 0.431798 1.205212 -0.178812
C 1.766464 1.681425 -0.026776
C 2.001400 3.005646 0.427154
C -0.436996 3.301488 0.643656
C 0.874492 3.793491 0.768921
C 3.409720 3.557079 0.511392
C 3.638824 0.190244 0.609812
C 4.583132 -0.771154 -0.066364
C 4.082036 -1.958484 -0.660658
C 5.973706 -0.505518 -0.113675
C 4.961499 -2.861056 -1.295550
C 6.856578 -1.412546 -0.743215
C 6.350757 -2.591606 -1.336577
H -3.725108 -1.699748 -0.885155
H -3.869735 -0.846249 0.676385
H -4.655121 1.232763 -0.595701
H -4.312287 0.371204 -2.127459
H -7.123654 -2.731202 -0.892596
H -5.518442 -2.916094 -1.612835
H -6.285601 -1.168659 1.722980
H -6.089110 0.391935 0.900164
H -1.946594 0.534377 -1.655503
H -4.587218 -3.660654 0.652012
H -6.222149 -3.509035 1.362034
H -5.913763 -4.714803 0.081308
H -8.201439 -0.036786 -0.442093
H -8.462294 -1.558574 0.463162
H -8.487939 -0.001176 1.329210
H -1.297842 3.904151 0.946499
H 1.033245 4.815533 1.130881
H 3.870261 3.344946 1.495871
H 4.052888 3.106450 -0.263580
H 3.409580 4.652277 0.379805
H 4.188634 0.962674 1.179578
H 2.924355 -0.329120 1.273869
H 3.005791 -2.162492 -0.626103
H 6.366419 0.412865 0.340714
H 4.567687 -3.774617 -1.754613
H 7.931139 -1.200531 -0.772706
H 7.032810 -3.295851 -1.826324


