%chk=000296187.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296187

0 1
O -0.320512 2.816866 -0.901991
O -3.059882 -2.788094 -0.282983
O 0.468978 2.211552 1.122820
N -1.553895 -1.502359 0.907505
N -2.412092 -0.802657 -1.229906
C -0.517491 -0.429564 0.884428
C -0.862348 0.649979 -0.122946
C 0.862590 -1.003132 0.592867
C -1.730768 0.422321 -1.154282
C -2.362239 -1.793967 -0.186364
C 1.967544 -0.456306 1.265151
C 1.062551 -2.033270 -0.332776
C -0.173934 1.910292 0.136602
C -2.034876 1.395108 -2.236828
C 3.449056 -1.998648 0.116354
C 3.249516 -0.950290 1.031637
C 2.346688 -2.532913 -0.566364
C 4.826414 -2.526040 -0.121990
C 0.305511 4.129345 -0.739980
C -0.561292 5.005917 0.140104
H -0.523726 0.027158 1.920290
H -1.425867 -2.243390 1.601718
H -3.051487 -0.995473 -2.005884
H 1.822284 0.378328 1.958176
H 0.221397 -2.454048 -0.881912
H -2.810240 1.080375 -2.944029
H -1.119906 1.626903 -2.816477
H -2.343790 2.371606 -1.811878
H 4.098973 -0.519447 1.557927
H 2.487138 -3.338542 -1.283831
H 5.277389 -2.898460 0.809123
H 4.847146 -3.353677 -0.842493
H 5.490236 -1.741381 -0.512988
H 1.320978 3.987551 -0.327057
H 0.350831 4.470249 -1.789454
H -0.187197 6.035669 0.173987
H -1.599586 5.035462 -0.210686
H -0.578591 4.628280 1.174610


%chk=000296187-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296187

0 1
O -0.402487 2.988034 -0.889717
O -3.095179 -2.749825 -0.180635
O 0.473965 2.278131 1.155011
N -1.538754 -1.380007 0.919272
N -2.273211 -0.835895 -1.240061
C -0.456025 -0.369985 0.870546
C -0.809078 0.717071 -0.159156
C 0.922314 -1.007488 0.593478
C -1.650562 0.417574 -1.218540
C -2.334146 -1.738585 -0.145595
C 2.082805 -0.470986 1.207331
C 1.067726 -2.119747 -0.271450
C -0.193418 2.019111 0.110593
C -2.009023 1.314070 -2.384946
C 3.507310 -2.143483 0.087678
C 3.352776 -1.030227 0.954912
C 2.342417 -2.675844 -0.519832
C 4.876726 -2.751577 -0.163901
C 0.186790 4.334982 -0.621295
C -0.761698 5.191109 0.223371
H -0.403617 0.122542 1.858156
H -1.562348 -2.022132 1.713108
H -2.882869 -1.086643 -2.019822
H 1.983163 0.399726 1.864654
H 0.187902 -2.568597 -0.745938
H -2.662516 0.784492 -3.101241
H -1.103902 1.659488 -2.908328
H -2.526838 2.222849 -2.036257
H 4.237665 -0.599686 1.440428
H 2.432950 -3.539588 -1.189925
H 5.279331 -3.224931 0.752068
H 4.837564 -3.525419 -0.949837
H 5.607317 -1.983850 -0.479621
H 1.158219 4.198911 -0.115125
H 0.337493 4.756354 -1.628733
H -0.341574 6.207300 0.343027
H -1.750153 5.281731 -0.260021
H -0.891532 4.752323 1.226542


