%chk=000201109.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201109

0 1
O -0.911578 -0.123528 0.856297
O 0.170424 1.817322 0.442961
O 6.159439 -0.689027 -0.723022
N -4.845726 -0.325433 0.460566
C -4.434742 1.124904 0.414656
C -4.170486 -0.866825 -0.773808
C -4.521327 1.543789 -1.083936
C -4.348583 0.226987 -1.869679
C -2.976966 1.156506 0.922631
C -2.683866 -1.040912 -0.391839
C -2.067189 0.297552 0.034178
C -6.321785 -0.517131 0.452699
C 0.151303 0.730634 0.975316
C 1.191096 0.093274 1.862254
C 2.500079 -0.077227 1.145291
C 3.116049 -1.341485 1.099394
C 3.122050 1.022612 0.538190
C 4.341904 -1.506259 0.465418
C 4.353049 0.881465 -0.106946
C 4.951404 -0.384328 -0.133951
C 6.879121 0.380879 -1.381202
H -5.080370 1.754037 1.060704
H -4.602305 -1.840531 -1.083076
H -3.749909 2.283545 -1.346021
H -5.490658 2.016998 -1.302208
H -5.229894 0.014301 -2.493785
H -3.487683 0.266156 -2.553153
H -2.599476 2.193747 0.967939
H -2.946666 0.764016 1.960905
H -2.604364 -1.759121 0.453637
H -2.113302 -1.483599 -1.225580
H -1.669690 0.874607 -0.827635
H -6.739183 -0.086050 1.377200
H -6.538751 -1.597447 0.473841
H -6.847168 -0.073672 -0.405413
H 0.811846 -0.879861 2.250298
H 1.332543 0.737409 2.760827
H 2.631800 -2.201497 1.562338
H 2.629236 1.999804 0.556372
H 4.836838 -2.473371 0.419309
H 4.818878 1.742288 -0.574186
H 7.771947 -0.142272 -1.747881
H 7.148575 1.157707 -0.660083
H 6.290484 0.780538 -2.211917


%chk=000201109-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201109

0 1
O -0.823187 -0.007763 1.285706
O -0.012052 2.159375 0.957495
O 5.687361 -0.941144 -1.174521
N -4.822566 -0.490719 0.235124
C -4.453283 0.948182 0.440727
C -3.860020 -0.889316 -0.843417
C -4.288138 1.541185 -1.009294
C -3.892078 0.298331 -1.878145
C -3.119678 0.976762 1.233087
C -2.463995 -1.050573 -0.186417
C -2.009083 0.291369 0.410667
C -6.244880 -0.700572 -0.123118
C 0.109401 1.014220 1.454535
C 1.300237 0.532058 2.279420
C 2.477204 0.170334 1.373003
C 2.824009 -1.185432 1.135628
C 3.230369 1.180590 0.729359
C 3.894716 -1.523350 0.286985
C 4.307859 0.860590 -0.126911
C 4.640676 -0.499296 -0.347836
C 6.478799 0.079483 -1.864252
H -5.239726 1.461136 1.021015
H -4.170505 -1.849096 -1.291352
H -3.524654 2.338511 -1.039006
H -5.237806 1.983235 -1.358898
H -4.643461 0.108454 -2.664932
H -2.917601 0.428898 -2.381899
H -2.825384 2.015654 1.468225
H -3.266376 0.424957 2.179064
H -2.541122 -1.802092 0.619069
H -1.721850 -1.407157 -0.924699
H -1.652945 0.980260 -0.378039
H -6.880552 -0.360020 0.713573
H -6.425395 -1.781091 -0.264780
H -6.581365 -0.172016 -1.047597
H 0.993331 -0.338251 2.880929
H 1.581037 1.355573 2.959734
H 2.247911 -1.984049 1.617426
H 2.963549 2.231976 0.887357
H 4.170126 -2.565952 0.101182
H 4.869988 1.666893 -0.607540
H 7.221415 -0.480683 -2.451295
H 6.996719 0.743792 -1.144871
H 5.849391 0.688252 -2.542591


