%chk=000272003.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272003

0 1
O 1.472163 2.707801 -0.477471
O 5.103118 -0.135683 -0.710042
N 2.884611 -0.533543 0.003800
N -1.205716 0.476570 0.811326
N 3.467088 1.551989 -0.715750
C 1.625572 0.275033 0.117302
C 0.521018 -0.272348 -0.800804
C 1.147139 0.357405 1.576060
C -0.781634 0.523875 -0.627648
C -0.172394 1.139213 1.676547
C 2.097957 1.682825 -0.379694
C 2.966376 -1.986528 0.343145
C 3.965532 0.211758 -0.494015
C -2.537372 1.147097 0.996797
C 3.999534 -2.195199 1.453089
C 3.319560 -2.790467 -0.910737
C -3.626661 0.368293 0.297502
C -4.537188 1.032729 -0.536762
C -3.751565 -1.014587 0.501614
C -5.567132 0.318251 -1.156220
C -4.779996 -1.723746 -0.122478
C -5.690950 -1.058948 -0.950834
H 0.333752 -1.339126 -0.555509
H 0.839804 -0.253822 -1.860002
H 1.916474 0.824060 2.219672
H 0.997468 -0.669525 1.971315
H -1.584263 0.056483 -1.241045
H -0.644666 1.564035 -1.003643
H -0.000262 2.207102 1.405433
H -0.530825 1.119235 2.728153
H 1.949877 -2.291280 0.712330
H 4.053661 2.300891 -1.071384
H -2.534207 2.209835 0.665352
H -2.763868 1.161004 2.089859
H 5.004868 -1.880760 1.129594
H 4.068212 -3.250540 1.737409
H 3.757102 -1.619637 2.352605
H 3.366682 -3.862955 -0.693836
H 2.588927 -2.642251 -1.712852
H 4.303477 -2.498107 -1.310830
H -4.447760 2.103821 -0.705307
H -3.032834 -1.528360 1.141103
H -6.273779 0.837764 -1.801067
H -4.873585 -2.796445 0.037189
H -6.493109 -1.612613 -1.433665


%chk=000272003-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272003

0 1
O 1.649763 2.807329 -0.485033
O 5.215685 -0.267081 -0.620588
N 2.921354 -0.525335 -0.001729
N -1.181884 0.585344 0.720179
N 3.620867 1.511308 -0.657959
C 1.708760 0.345998 0.080937
C 0.580774 -0.146893 -0.874348
C 1.160415 0.427760 1.537156
C -0.731182 0.641095 -0.694791
C -0.173920 1.196003 1.623323
C 2.273146 1.719545 -0.380492
C 2.932717 -1.973685 0.339096
C 4.044891 0.156768 -0.437699
C -2.529755 1.177282 0.904771
C 3.874716 -2.258975 1.532880
C 3.283149 -2.836199 -0.896588
C -3.640122 0.351758 0.260265
C -4.733097 0.988013 -0.377333
C -3.619253 -1.064507 0.331790
C -5.791737 0.227430 -0.926237
C -4.672277 -1.827203 -0.218939
C -5.764980 -1.183750 -0.848095
H 0.383030 -1.211831 -0.646764
H 0.922795 -0.081134 -1.923961
H 1.913686 0.898408 2.196122
H 0.991494 -0.606043 1.894721
H -1.513175 0.183914 -1.326801
H -0.590527 1.694693 -1.033938
H -0.001557 2.272249 1.385229
H -0.552532 1.135500 2.661273
H 1.897188 -2.213071 0.648205
H 4.266116 2.230698 -0.985582
H -2.582684 2.227736 0.521512
H -2.709855 1.233221 1.997785
H 4.915959 -2.010841 1.266969
H 3.826941 -3.329373 1.803587
H 3.585403 -1.663093 2.417109
H 3.238444 -3.908545 -0.633203
H 2.573850 -2.651405 -1.723176
H 4.302178 -2.603927 -1.248532
H -4.755204 2.083065 -0.447634
H -2.761796 -1.549007 0.812423
H -6.630440 0.734043 -1.417398
H -4.644341 -2.921454 -0.157708
H -6.582799 -1.775211 -1.275205


