%chk=000224411.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224411

0 1
O -2.290365 -2.509806 1.335380
O -2.841284 -0.799762 2.672371
N -3.892739 0.176633 0.077625
C 2.517878 0.161903 0.203978
C 2.795667 -0.352714 -1.223300
C 3.632581 1.136182 0.641125
C 1.143732 0.857332 0.292394
C 4.173884 -1.022315 -1.310720
C 5.012660 0.469926 0.555204
C 5.286853 -0.067595 -0.856341
C -0.016846 -0.140254 0.190558
C -1.372166 0.570354 0.281238
C -2.545372 -0.428918 0.228579
C -2.604349 -1.187199 1.555392
C -4.182472 0.620728 -1.321703
C -5.442355 1.482748 -1.336603
H 2.523836 -0.710975 0.901572
H 2.010188 -1.069174 -1.526425
H 2.740844 0.485429 -1.942912
H 3.614078 2.040357 0.004348
H 3.449222 1.483247 1.674414
H 1.057787 1.624478 -0.499976
H 1.072001 1.409040 1.250493
H 4.187201 -1.936302 -0.686501
H 4.363953 -1.356884 -2.347296
H 5.797437 1.194288 0.841854
H 5.075934 -0.356588 1.288837
H 5.368796 0.776102 -1.567917
H 6.262954 -0.586006 -0.880345
H 0.069236 -0.899515 0.993988
H 0.052756 -0.704799 -0.760636
H -1.425720 1.173899 1.210517
H -1.472392 1.295811 -0.550118
H -2.383545 -1.169935 -0.603541
H -4.018155 0.949947 0.742105
H -3.336567 1.174289 -1.785952
H -4.342384 -0.298121 -1.932207
H -5.755338 1.701394 -2.364080
H -5.298299 2.440364 -0.824049
H -6.280559 0.970596 -0.841994
H -2.330773 -3.059986 2.161344


%chk=000224411-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000224411

0 1
O -2.162596 -2.707517 0.769622
O -2.959298 -1.203509 2.346999
N -3.933878 0.208397 0.023511
C 2.573828 0.230444 0.225187
C 2.897534 -0.717943 -0.959957
C 3.656048 1.337137 0.330854
C 1.160021 0.856877 0.119870
C 4.327845 -1.301969 -0.864606
C 5.087059 0.757669 0.430226
C 5.392523 -0.185849 -0.757686
C -0.006117 -0.158431 0.138095
C -1.385578 0.535289 0.197180
C -2.603443 -0.433837 0.026248
C -2.611955 -1.444906 1.169056
C -4.245467 1.105818 -1.105092
C -5.721135 1.540217 -1.052680
H 2.613418 -0.372610 1.160787
H 2.162718 -1.544760 -1.004361
H 2.796445 -0.147310 -1.908599
H 3.589431 1.988198 -0.567378
H 3.444568 1.982541 1.207148
H 1.101828 1.462688 -0.810044
H 1.025625 1.568736 0.962120
H 4.394561 -1.953542 0.031832
H 4.533874 -1.945516 -1.742310
H 5.828614 1.579556 0.469542
H 5.186750 0.190568 1.379315
H 5.399367 0.403537 -1.698449
H 6.402457 -0.627185 -0.648348
H 0.113354 -0.834525 1.009351
H 0.037104 -0.802993 -0.762357
H -1.499374 1.076318 1.158396
H -1.446553 1.290370 -0.611568
H -2.481112 -0.989770 -0.921658
H -4.170351 0.602732 0.944034
H -3.598867 2.016989 -1.143698
H -4.057815 0.546541 -2.043551
H -5.968114 2.195017 -1.907962
H -5.936756 2.102820 -0.124187
H -6.381578 0.656335 -1.077052
H -2.177185 -3.324423 1.552871


