%chk=000201682.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201682

0 1
O 0.846296 -3.305616 -0.007306
N -2.226488 0.006832 0.040385
N 2.143567 0.224345 0.076202
C 0.086886 -0.988061 -0.509657
C -1.470859 -1.180689 -0.455534
C 0.242000 -2.130704 0.537242
C -1.285964 -2.326229 0.582419
C 0.653091 0.352147 -0.048965
C -3.573422 -0.390118 0.574129
C -2.376566 1.015337 -1.065189
C -4.301527 0.845511 1.128864
C -3.081192 2.274171 -0.534549
C -4.454634 1.928142 0.053685
C 2.807460 0.362600 -1.262700
C 2.677782 1.238445 1.045735
C 4.324625 0.155307 -1.120891
C 4.193285 1.045492 1.223147
C 4.925179 1.150751 -0.120458
H 0.493832 -1.272421 -1.498278
H -1.863667 -1.563431 -1.423009
H 0.742193 -1.863054 1.479413
H -1.731989 -2.145002 1.566913
H -1.614131 -3.311950 0.229380
H 0.328425 1.159015 -0.744431
H 0.213074 0.615644 0.940895
H -3.412700 -1.121589 1.396969
H -4.204342 -0.892490 -0.189900
H -2.930781 0.612103 -1.939912
H -1.354790 1.282638 -1.420952
H -3.729476 1.252492 1.986861
H -5.289690 0.548007 1.523298
H -3.182740 3.015159 -1.347526
H -2.451577 2.746055 0.246158
H 2.604472 1.344298 -1.742317
H 2.386182 -0.418844 -1.931951
H 2.167844 1.075405 2.020226
H 2.463626 2.283511 0.735526
H -5.135328 1.579049 -0.745404
H -4.923951 2.831158 0.485245
H 1.805170 -3.152100 -0.133284
H 4.808579 0.258251 -2.108568
H 4.523884 -0.879873 -0.779203
H 4.385369 0.051163 1.673949
H 4.582364 1.793694 1.936690
H 6.003785 0.950854 0.016013
H 4.850244 2.181097 -0.515958


%chk=000201682-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201682

0 1
O 1.274207 -2.655597 0.672089
N -2.322892 -0.045081 0.019874
N 2.152295 0.326671 -0.113664
C 0.043757 -0.829658 -0.668997
C -1.523648 -1.093929 -0.663831
C 0.144261 -1.747179 0.583469
C -1.220729 -2.372733 0.211677
C 0.719482 0.535170 -0.496096
C -3.655312 -0.531594 0.475693
C -2.507907 1.136975 -0.869805
C -4.401307 0.560643 1.270661
C -3.205143 2.295379 -0.129503
C -4.574474 1.842221 0.424830
C 3.010145 0.043866 -1.299057
C 2.698263 1.463278 0.678771
C 4.453168 -0.299598 -0.878242
C 4.128043 1.159300 1.169468
C 5.060228 0.834221 -0.020482
H 0.465774 -1.374733 -1.535317
H -1.947408 -1.320627 -1.672415
H 0.056476 -1.130675 1.502167
H -1.905027 -2.624829 1.035186
H -1.080446 -3.257456 -0.432896
H 0.642563 1.170079 -1.413524
H 0.217102 1.074032 0.328821
H -3.516806 -1.421789 1.111187
H -4.285507 -0.843644 -0.400428
H -3.120177 0.855263 -1.769101
H -1.523007 1.463470 -1.242521
H -3.817912 0.794218 2.182514
H -5.385612 0.169522 1.593450
H -3.327337 3.152592 -0.819874
H -2.556957 2.626786 0.705138
H 3.028652 0.929797 -1.987320
H 2.569011 -0.798761 -1.860709
H 2.027531 1.634997 1.540724
H 2.712085 2.406292 0.071136
H -5.260859 1.633300 -0.422230
H -5.038674 2.646901 1.025984
H 2.072981 -2.063220 0.731342
H 5.065933 -0.476713 -1.782971
H 4.444111 -1.242375 -0.295865
H 4.090924 0.293120 1.858877
H 4.512343 2.025480 1.741727
H 6.066924 0.551376 0.340719
H 5.184283 1.741745 -0.647252


