%chk=000212375.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212375

0 1
O 2.976206 0.626417 0.200733
O 3.120800 -1.587292 -0.330632
N -1.340522 -0.587417 0.408761
N 1.465545 -0.823668 1.140602
N -4.841738 0.436102 -0.534146
C -0.474274 0.634196 0.497829
C -0.536416 -1.765480 -0.056780
C 0.665544 0.378935 1.504841
C 0.611156 -2.030592 0.938634
C -2.514272 -0.352025 -0.493866
C -3.620765 0.342378 0.331197
C 2.546806 -0.682942 0.246820
C -4.801477 1.659862 -1.389150
C -6.082179 0.427427 0.297087
C 4.254133 0.885220 -0.507448
C 3.968874 0.904892 -1.998843
C 4.672348 2.228445 0.066615
H -1.102077 1.476791 0.859963
H -0.051543 0.943442 -0.482553
H -0.128473 -1.639304 -1.082755
H -1.207707 -2.652151 -0.080384
H 1.332729 1.267458 1.572132
H 0.246521 0.194497 2.521297
H 0.200738 -2.306758 1.937278
H 1.241973 -2.879138 0.587346
H -2.265602 0.241637 -1.397550
H -2.907985 -1.325416 -0.864102
H -3.836518 -0.278165 1.229377
H -3.271172 1.323155 0.712934
H -4.820053 2.611596 -0.838699
H -5.663016 1.641562 -2.076145
H -3.892897 1.637005 -2.011066
H -6.132809 -0.523581 0.852115
H -6.959889 0.456484 -0.368572
H -6.166706 1.255436 1.015304
H 4.954620 0.065554 -0.230917
H 4.850157 1.208225 -2.574154
H 3.672805 -0.096288 -2.349179
H 3.152239 1.592016 -2.248605
H 5.624272 2.563247 -0.360139
H 4.788095 2.173588 1.157278
H 3.921828 3.004155 -0.133360


%chk=000212375-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212375

0 1
O 3.232470 0.732270 0.205377
O 3.346715 -1.575685 -0.262362
N -1.506841 -0.540637 0.178992
N 1.351029 -0.572831 0.458038
N -5.226435 0.275054 -0.150295
C -0.725074 0.721081 0.099821
C -0.705948 -1.673492 -0.355366
C 0.583595 0.603851 0.907052
C 0.595621 -1.840184 0.450829
C -2.839684 -0.443243 -0.469038
C -3.846116 0.357049 0.385821
C 2.684001 -0.563394 0.104209
C -5.416424 1.045711 -1.397095
C -6.236289 0.635596 0.866720
C 4.672300 0.860769 -0.205350
C 4.755893 0.962971 -1.735269
C 5.188186 2.101299 0.528594
H -1.325622 1.548515 0.516770
H -0.476584 0.976938 -0.963083
H -0.448121 -1.525996 -1.435500
H -1.303580 -2.599458 -0.270653
H 1.201233 1.504512 0.781805
H 0.331410 0.486575 1.980818
H 0.341853 -2.120774 1.493006
H 1.237910 -2.622044 0.015077
H -2.758969 -0.010109 -1.497846
H -3.248638 -1.464256 -0.577738
H -3.838862 -0.088150 1.397239
H -3.514163 1.422994 0.493221
H -5.246749 2.145819 -1.262551
H -6.448573 0.902596 -1.763908
H -4.728764 0.687199 -2.181250
H -6.122922 -0.015120 1.751739
H -7.249413 0.478401 0.454359
H -6.166225 1.700693 1.207894
H 5.189887 -0.054310 0.137371
H 5.809288 1.081358 -2.050180
H 4.356883 0.048020 -2.204059
H 4.184219 1.836299 -2.097699
H 6.259157 2.254095 0.302484
H 5.073486 1.986820 1.620080
H 4.634161 3.002701 0.211022


