%chk=000213872.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213872

0 1
O 2.766702 -1.638333 0.419319
O 3.403745 1.149228 -0.219172
N -2.956483 0.497670 -0.074003
N -2.595701 -1.693666 0.354396
N -3.921587 -1.489295 0.304379
C -0.563592 -0.132331 0.066106
C -0.249917 1.226329 -0.198104
C -1.954889 -0.506960 0.129438
C 0.460514 -1.087463 0.245547
C 1.104449 1.623553 -0.251986
C -1.317822 2.192979 -0.396205
C 1.785289 -0.684925 0.173409
C 2.112194 0.684497 -0.062546
C -2.628935 1.843191 -0.335772
C -4.190361 -0.182479 0.048694
C 3.497800 -2.030248 -0.777523
C 4.318033 0.835726 0.869254
H 0.208180 -2.135805 0.438491
H 1.373347 2.662921 -0.441343
H -1.031735 3.227172 -0.598466
H -3.460729 2.536266 -0.477282
H -5.158833 0.276365 -0.047658
H 4.237944 -2.730485 -0.374385
H 3.972586 -1.157578 -1.237628
H 2.818308 -2.530968 -1.473046
H 4.297126 -0.232789 1.114736
H 4.051712 1.446517 1.736442
H 5.283855 1.136310 0.448509


%chk=000213872-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213872

0 1
O 2.754527 -1.737768 0.329604
O 3.464910 1.035364 -0.253719
N -2.978761 0.514955 -0.039695
N -2.606506 -1.674526 0.450968
N -4.009082 -1.438162 0.419799
C -0.599839 -0.146440 0.070525
C -0.259664 1.216050 -0.248003
C -1.999677 -0.488769 0.173379
C 0.422164 -1.113135 0.252539
C 1.114363 1.573917 -0.337311
C -1.320482 2.189798 -0.451156
C 1.770220 -0.747605 0.132801
C 2.122448 0.621444 -0.132976
C -2.646323 1.841945 -0.347962
C -4.203513 -0.134376 0.128462
C 3.593277 -2.028925 -0.860008
C 4.288631 0.869785 0.970425
H 0.160859 -2.152386 0.470909
H 1.410555 2.605636 -0.553741
H -1.061664 3.224649 -0.691718
H -3.474198 2.538489 -0.491686
H -5.169861 0.352531 0.033831
H 4.326028 -2.776660 -0.521967
H 4.103697 -1.117325 -1.218849
H 2.965977 -2.453290 -1.665671
H 4.289790 -0.181168 1.308756
H 3.901376 1.524144 1.773487
H 5.301949 1.187225 0.682576


