%chk=000222059.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222059

0 1
O -0.536722 1.031811 0.933174
O -0.303930 0.554594 -1.260844
N -4.223946 0.766284 0.390512
C -2.845781 0.285618 0.763930
C -4.310783 1.136117 -1.066575
C -5.299780 -0.264649 0.576330
C -4.896153 -0.064872 -1.840386
C -5.539799 -0.971273 -0.776890
C -1.913950 1.531142 0.714484
C 2.642378 0.821306 -0.481320
C 1.530729 0.096520 0.331752
C 2.441150 2.350587 -0.420822
C -2.820521 -0.355370 2.153673
C 3.670294 3.078867 -0.977300
C 0.163047 0.558954 -0.143481
C 4.004970 0.418999 0.022102
C -2.103518 2.546560 1.821778
C 4.927366 2.736904 -0.163416
C 1.619081 -1.407050 0.196229
C 5.026640 1.271871 0.141978
C 2.019419 -2.178883 1.296973
C 1.316885 -2.035958 -1.021409
C 2.120888 -3.567871 1.176291
C 1.419654 -3.423894 -1.135648
C 1.823186 -4.192522 -0.038569
H -2.451233 -0.460188 0.021146
H -3.333787 1.454228 -1.479158
H -4.990036 2.012565 -1.126801
H -6.207913 0.291391 0.894721
H -5.067870 -0.985303 1.380154
H -5.630655 0.265848 -2.591400
H -4.105646 -0.601244 -2.392152
H -5.084004 -1.974969 -0.785951
H -6.615543 -1.115028 -0.964083
H -1.939114 2.002693 -0.295814
H 2.565855 0.493940 -1.552494
H 1.643823 0.386895 1.412604
H 2.259106 2.670637 0.623171
H 1.540983 2.638730 -0.996498
H -3.273352 -1.352646 2.150239
H -3.356709 0.253875 2.891701
H -1.783441 -0.461807 2.500815
H 3.498741 4.170932 -0.971507
H 3.824400 2.796937 -2.037306
H 4.118239 -0.639733 0.256649
H -3.174180 2.772422 1.946266
H -1.729426 2.169912 2.783099
H -1.574549 3.482089 1.611539
H 4.923545 3.300421 0.793750
H 5.830682 3.074352 -0.709549
H 6.005432 0.940540 0.487657
H 2.252749 -1.700576 2.246676
H 0.988747 -1.436979 -1.875025
H 2.432495 -4.163777 2.032539
H 1.183717 -3.907687 -2.082377
H 1.903642 -5.273662 -0.130358


%chk=000222059-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222059

0 1
O -0.551720 1.081814 1.217466
O -0.278764 0.985828 -1.099343
N -4.175029 0.769218 0.252712
C -2.870899 0.267560 0.800270
C -4.118047 1.011749 -1.226832
C -5.370129 -0.108796 0.401270
C -4.639267 -0.297907 -1.929897
C -5.314342 -1.120189 -0.785701
C -1.983109 1.531267 1.032916
C 2.639275 0.951059 -0.530089
C 1.567625 0.280054 0.398817
C 2.621748 2.494905 -0.385714
C -3.010630 -0.574474 2.080473
C 3.831285 3.134413 -1.104370
C 0.174178 0.816626 0.061108
C 4.028740 0.397437 -0.248332
C -2.335069 2.365312 2.260645
C 5.162501 2.657826 -0.476913
C 1.541586 -1.251188 0.286329
C 5.152152 1.162626 -0.211555
C 1.884542 -2.054224 1.402191
C 1.189141 -1.886919 -0.932833
C 1.884964 -3.464488 1.304655
C 1.189114 -3.295478 -1.031914
C 1.538467 -4.090327 0.085344
H -2.339138 -0.356422 0.043193
H -3.092929 1.271664 -1.540043
H -4.780855 1.862110 -1.474602
H -6.270256 0.530143 0.301771
H -5.409386 -0.582852 1.393135
H -5.360510 -0.048994 -2.728587
H -3.812251 -0.861463 -2.395483
H -4.690975 -1.991969 -0.512419
H -6.314679 -1.496898 -1.063569
H -2.009460 2.148220 0.116776
H 2.350342 0.697043 -1.573058
H 1.784419 0.551813 1.447585
H 2.659074 2.760085 0.691604
H 1.677041 2.900418 -0.793247
H -3.453053 -1.562972 1.866498
H -3.634173 -0.068401 2.838656
H -2.008199 -0.744733 2.511882
H 3.762574 4.238210 -1.064402
H 3.807921 2.847845 -2.174635
H 4.107370 -0.683942 -0.072894
H -3.406558 2.625542 2.210489
H -2.142850 1.811807 3.195302
H -1.742604 3.296089 2.282897
H 5.351553 3.199539 0.474963
H 6.013085 2.913122 -1.140481
H 6.116738 0.686020 0.015365
H 2.154131 -1.571653 2.349463
H 0.902271 -1.275694 -1.796393
H 2.154725 -4.071376 2.176474
H 0.915399 -3.774038 -1.979174
H 1.538423 -5.183370 0.007029


