%chk=000219713.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219713

0 1
O -3.292367 2.008969 1.069358
O 5.745002 1.083993 -0.074107
N -0.482512 -0.303282 -0.559836
C -2.844591 0.038189 -0.231029
C -3.336181 -1.371972 0.149886
C -4.819073 -1.549421 -0.194342
C -5.685079 -0.491548 0.500668
C -5.222643 0.929672 0.161924
C -3.741443 1.095680 0.415674
C -1.397967 0.225498 0.176899
C 0.913301 -0.189759 -0.294567
C 1.613789 -1.328872 0.150150
C 1.603836 1.001543 -0.589831
C 3.698614 -0.091636 -0.005093
C 2.998760 -1.271494 0.289579
C 2.988313 1.039861 -0.446409
C 5.179928 0.027676 0.127649
C 5.957711 -1.199134 0.515116
H -2.930183 0.154970 -1.346420
H -3.168397 -1.552812 1.229380
H -2.724510 -2.126394 -0.386330
H -5.152290 -2.562778 0.103290
H -4.962636 -1.496862 -1.291425
H -5.655199 -0.640349 1.598924
H -6.745768 -0.616107 0.207834
H -5.790602 1.674092 0.758741
H -5.443316 1.169497 -0.898143
H -1.251195 0.819842 1.097376
H 1.073373 -2.247757 0.368401
H 1.061534 1.878672 -0.938065
H 3.532772 -2.158441 0.633008
H 3.542625 1.958094 -0.672735
H 5.813715 -2.018905 -0.199610
H 5.677891 -1.563258 1.511363
H 7.036788 -0.979370 0.543518


%chk=000219713-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219713

0 1
O -2.996644 2.116031 0.164540
O 5.583004 1.291233 0.815882
N -0.449650 -0.619389 -0.637661
C -2.845170 -0.297144 -0.245486
C -3.563881 -1.367339 0.650186
C -5.068931 -1.465228 0.313720
C -5.771650 -0.098104 0.468559
C -5.088925 0.987809 -0.412862
C -3.590101 1.046839 -0.143090
C -1.391080 -0.147786 0.128572
C 0.923984 -0.414937 -0.335893
C 1.827843 -1.491554 -0.545507
C 1.429398 0.849083 0.092331
C 3.709861 -0.070966 0.152741
C 3.200105 -1.323708 -0.290497
C 2.803252 1.011181 0.330494
C 5.166598 0.158444 0.426971
C 6.144315 -0.997897 0.231426
H -2.902851 -0.646450 -1.296502
H -3.437642 -1.093719 1.717301
H -3.064048 -2.341917 0.501382
H -5.547234 -2.214248 0.972938
H -5.191594 -1.828669 -0.726884
H -5.735674 0.219508 1.529548
H -6.839240 -0.176158 0.191415
H -5.521747 1.987868 -0.239774
H -5.242135 0.726897 -1.480750
H -1.182696 0.360119 1.091975
H 1.429811 -2.445900 -0.904192
H 0.740657 1.694362 0.204070
H 3.877458 -2.169914 -0.446107
H 3.212916 1.973068 0.657046
H 6.135326 -1.352320 -0.816305
H 5.879872 -1.857669 0.874900
H 7.158493 -0.655330 0.486308


