%chk=000216487.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216487

1 1
O -1.798138 1.333159 -0.624970
O 4.080035 -0.394559 0.600655
O 7.437955 0.145781 -0.218610
O 6.479516 -1.199740 1.197019
N -4.309694 0.478195 0.176388
N -4.326492 1.905386 0.464886
N -0.603732 -0.162319 0.706198
N 0.597130 0.276694 0.176595
N 6.475775 -0.338550 0.342838
C -5.560228 -0.113257 0.864908
C -4.352316 0.174696 -1.331135
C -5.696432 -1.611195 0.594687
C -4.483845 -1.322913 -1.605472
C -5.703173 -1.923564 -0.903250
C -3.056484 -0.095382 0.836302
C -1.757014 0.454925 0.208924
C 1.709241 -0.228131 0.635398
C 2.953824 0.247693 0.053980
C 3.327499 1.173269 -0.899847
C 5.165786 0.184549 -0.067553
C 4.758365 1.133582 -0.979151
H -6.461920 0.426791 0.486975
H -5.511031 0.102357 1.959643
H -3.433888 0.588713 -1.825594
H -5.218057 0.717634 -1.778727
H -6.646879 -1.968250 1.058078
H -4.904077 -2.190293 1.110584
H -3.559437 -1.866397 -1.324855
H -4.569230 -1.475206 -2.707703
H -5.726092 -3.024365 -1.060063
H -6.639911 -1.554144 -1.371041
H -3.094509 -1.210656 0.765996
H -3.073635 0.159862 1.929892
H -5.130308 2.371980 0.016699
H -3.466059 2.377579 0.111264
H -0.643619 -0.873065 1.448502
H 1.836378 -0.990832 1.428449
H 2.675719 1.809777 -1.478863
H 5.385573 1.731397 -1.626327


%chk=000216487-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216487

1 1
O -1.882277 1.778577 -0.442357
O 4.000327 -0.559102 0.461924
O 7.462346 -0.059594 -0.277264
O 6.407778 -1.690328 0.960881
N -4.364480 0.501711 0.170434
N -4.522343 1.965786 0.381340
N -0.659444 0.041945 0.557766
N 0.562525 0.534109 0.099407
N 6.416845 -0.627375 0.232425
C -5.580589 -0.173214 0.857038
C -4.345477 0.106641 -1.336936
C -5.621180 -1.695959 0.645487
C -4.357519 -1.416074 -1.548159
C -5.569727 -2.074830 -0.852199
C -3.081548 0.111578 0.915207
C -1.822998 0.729866 0.261981
C 1.630751 -0.157484 0.454495
C 2.937755 0.264074 0.022061
C 3.445349 1.317407 -0.753164
C 5.155002 0.015294 -0.061014
C 4.866157 1.156700 -0.806069
H -6.468383 0.302302 0.401096
H -5.534419 0.123994 1.917039
H -3.470342 0.604936 -1.781445
H -5.262360 0.562307 -1.753626
H -6.562309 -2.054182 1.101447
H -4.809368 -2.198063 1.205536
H -3.408549 -1.870604 -1.203022
H -4.394798 -1.590804 -2.638915
H -5.523289 -3.171669 -0.961413
H -6.503435 -1.745257 -1.348733
H -3.032934 -0.986853 0.957945
H -3.207311 0.517270 1.934358
H -5.410859 2.266095 -0.049862
H -3.684762 2.420941 -0.038732
H -0.700208 -0.812223 1.138331
H 1.606944 -1.069307 1.081016
H 2.850561 2.100667 -1.217647
H 5.595161 1.781920 -1.314958


