%chk=000218505.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218505

0 1
O 5.308062 -0.276686 0.788876
N 0.104516 -0.992131 -0.921906
N -1.916603 2.223063 -1.029196
N -5.047618 -0.891631 0.100607
C -0.411753 0.301146 -0.766581
C -1.815016 0.727531 -1.082495
C 0.584095 1.142865 -0.263995
C 0.344848 2.586924 -0.025186
C 1.773877 0.364563 -0.102972
C -1.168695 2.859961 0.100547
C 1.457005 -0.975949 -0.525154
C -2.825161 0.052203 -0.168652
C -0.616115 -2.153704 -1.449393
C 3.074584 0.664445 0.356547
C 2.419666 -2.010330 -0.495918
C 3.991668 -0.370261 0.373888
C 3.683710 -1.704998 -0.045628
C -2.549986 -0.196023 1.183067
C -4.091224 -0.312110 -0.667850
C -3.527206 -0.789558 1.985155
C -4.764034 -1.123401 1.408906
C 5.781549 1.018644 1.224319
H -2.040365 0.459947 -2.156610
H 0.870418 2.936624 0.883846
H 0.761903 3.170011 -0.876146
H -1.526029 2.521104 1.096942
H -1.356872 3.954123 0.036442
H -2.907259 2.489692 -0.970814
H -1.682852 -2.122051 -1.160531
H -0.554422 -2.189048 -2.553019
H -0.191991 -3.092741 -1.051856
H 3.310776 1.672658 0.670510
H 2.163983 -3.014270 -0.823336
H 4.473797 -2.451568 0.002721
H -1.574091 0.066604 1.600529
H -4.362950 -0.139037 -1.716366
H -3.335331 -0.991957 3.036448
H -5.561451 -1.591303 1.997720
H 5.224184 1.350362 2.104873
H 5.717082 1.741741 0.406089
H 6.827302 0.803647 1.477971


%chk=000218505-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000218505

0 1
O 5.396849 -0.257031 0.784063
N 0.129213 -1.021840 -0.953027
N -1.881537 2.167759 -1.044768
N -5.163409 -0.743796 0.174225
C -0.391383 0.275297 -0.787789
C -1.814537 0.671504 -1.088005
C 0.590824 1.123267 -0.272881
C 0.325314 2.580949 0.011081
C 1.794829 0.335469 -0.121722
C -1.201564 2.811475 0.107511
C 1.478323 -0.999077 -0.556913
C -2.842741 0.021991 -0.140224
C -0.548587 -2.178078 -1.540268
C 3.105698 0.634294 0.342670
C 2.443234 -2.031280 -0.548809
C 4.060076 -0.403929 0.352783
C 3.734401 -1.723014 -0.088784
C -2.564027 -0.253854 1.223843
C -4.156254 -0.252498 -0.605352
C -3.594008 -0.753516 2.050318
C -4.872847 -0.979607 1.489340
C 5.805236 1.067741 1.244153
H -2.082467 0.377453 -2.124891
H 0.806928 2.902076 0.955980
H 0.738040 3.214633 -0.799038
H -1.567289 2.434177 1.093124
H -1.426813 3.892233 0.063907
H -2.852373 2.489402 -1.155381
H -1.639399 -2.030142 -1.509543
H -0.240506 -2.342283 -2.591126
H -0.317245 -3.089069 -0.960061
H 3.354179 1.646972 0.674016
H 2.209706 -3.045344 -0.889981
H 4.522227 -2.481581 -0.058770
H -1.552144 -0.098289 1.614834
H -4.416772 -0.075675 -1.658597
H -3.412425 -0.975610 3.106879
H -5.695727 -1.371387 2.097902
H 5.214366 1.390962 2.124726
H 5.707148 1.824166 0.439824
H 6.863467 0.964183 1.527147


