%chk=000235483.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235483

0 1
O -2.026088 -1.008535 0.950969
O -2.703155 -2.711679 -1.621511
O -3.698099 0.588069 -1.501438
O -4.715253 1.473831 0.854706
O 3.873850 -1.809583 0.825220
N -0.375050 -0.141982 -0.503381
N 0.383519 1.996253 -0.914535
N 1.778772 -1.176834 0.233465
N 3.657380 0.452336 0.191948
N 3.385947 2.703900 -0.467851
C -2.359648 -1.343867 -1.411394
C -1.306921 -1.256343 -0.267088
C -3.630667 -0.673017 -0.833859
C -3.375099 -0.541543 0.690823
C -3.459958 0.891540 1.236316
C 0.992715 -0.140854 -0.193082
C -0.685942 1.207039 -0.926489
C 1.452862 1.196863 -0.463650
C 2.835343 1.469735 -0.249331
C 3.089055 -0.790194 0.400869
C 5.288505 -1.511886 1.045381
H -2.036168 -0.867400 -2.362298
H -0.740794 -2.202698 -0.063798
H -4.547319 -1.257588 -1.064582
H -4.011925 -1.244962 1.271417
H -2.709596 1.561520 0.768867
H -3.331247 0.918822 2.331557
H -2.086953 -3.126123 -2.265435
H -4.402817 1.162712 -1.083985
H -1.699009 1.469719 -1.232133
H -5.445254 1.115093 1.399510
H 2.807775 3.466800 -0.787922
H 4.365991 2.870536 -0.307518
H 5.393476 -0.746869 1.820849
H 5.753125 -1.188990 0.108773
H 5.656444 -2.490222 1.375808


%chk=000235483-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235483

0 1
O -2.051733 -0.753408 1.051363
O -2.629554 -2.704537 -1.359487
O -3.558830 0.788095 -1.437795
O -5.222536 1.211626 0.703864
O 3.868028 -1.876391 0.768554
N -0.311354 0.073035 -0.433267
N 0.554779 2.142207 -0.932371
N 1.769898 -1.094206 0.232250
N 3.735251 0.377997 0.088734
N 3.610610 2.631706 -0.608408
C -2.271306 -1.284278 -1.302005
C -1.250655 -1.017181 -0.157806
C -3.562211 -0.561445 -0.869660
C -3.482863 -0.569925 0.685817
C -3.957250 0.750391 1.326046
C 1.067260 -0.010955 -0.188221
C -0.559728 1.394113 -0.877508
C 1.580688 1.274252 -0.501724
C 2.985093 1.442669 -0.342308
C 3.098883 -0.806850 0.343529
C 5.316282 -1.640130 0.917733
H -1.905576 -0.909906 -2.276422
H -0.616686 -1.897650 0.056884
H -4.434729 -1.135377 -1.231780
H -4.038125 -1.442182 1.082277
H -3.224967 1.542463 1.111558
H -4.066740 0.648843 2.420653
H -1.829107 -3.242664 -1.584626
H -4.358913 1.251621 -1.056919
H -1.563933 1.708106 -1.158576
H -5.987686 0.690170 1.050108
H 3.059847 3.425679 -0.927865
H 4.617110 2.707268 -0.482434
H 5.509449 -0.846170 1.659191
H 5.767121 -1.346058 -0.045535
H 5.711981 -2.607331 1.261353


