%chk=000245865.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245865

0 1
O 5.042821 -0.141338 -0.695135
O -0.744440 -2.893005 -0.204265
O -3.110566 -1.864343 -0.916178
N 2.504511 -0.578943 0.547437
C 2.636448 -0.535728 -0.947016
C 3.766181 -1.126108 1.150503
C 1.332231 -1.424350 0.955045
C 3.834251 0.354080 -1.309635
C 4.935283 -0.215975 0.740708
C 0.036159 -0.773002 0.545783
C -0.195243 0.599361 0.742048
C -0.985803 -1.548728 -0.017615
C -1.412447 1.185897 0.389702
C -2.223299 -0.950701 -0.375222
C -2.442279 0.406810 -0.174684
C -1.646604 2.654713 0.623132
C -1.959404 3.387674 -0.650113
C -4.407344 -1.368252 -1.326235
C -2.833047 4.389270 -0.726060
H 1.701412 -0.102720 -1.365223
H 2.760453 -1.543022 -1.399602
H 3.978323 -2.171942 0.840137
H 3.657650 -1.123022 2.255589
H 1.340658 -1.515858 2.067286
H 1.381193 -2.464961 0.552614
H 4.079766 0.307233 -2.384616
H 3.677431 1.400834 -0.995252
H 4.818937 0.805017 1.145131
H 5.913448 -0.636865 1.030740
H 0.611119 1.200487 1.168432
H -3.383146 0.876665 -0.445211
H -2.460531 2.779557 1.370928
H -0.754922 3.129181 1.092319
H -1.536241 -3.334483 -0.617897
H -1.398450 3.043831 -1.522025
H -4.293314 -0.620251 -2.116520
H -4.949423 -0.970551 -0.463095
H -4.885111 -2.279342 -1.708683
H -3.038087 4.925266 -1.641125
H -3.406977 4.756215 0.111473


%chk=000245865-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245865

0 1
O 5.238333 -0.044421 -0.461368
O -0.950380 -2.978071 -0.183666
O -3.272841 -1.830167 -0.780188
N 2.569510 -0.695022 0.485032
C 2.853645 -0.527476 -0.964451
C 3.777187 -1.190881 1.191294
C 1.376754 -1.542178 0.732249
C 4.032948 0.437438 -1.158643
C 4.944870 -0.214782 0.971623
C 0.072303 -0.835265 0.384669
C -0.073848 0.570168 0.517410
C -1.041925 -1.582708 -0.046430
C -1.289151 1.227473 0.227394
C -2.269812 -0.929802 -0.350494
C -2.401531 0.461797 -0.217186
C -1.429515 2.740122 0.416892
C -2.084626 3.444713 -0.757352
C -4.578330 -1.271643 -1.131638
C -3.200963 4.212999 -0.681795
H 1.953466 -0.121255 -1.461102
H 3.098127 -1.509469 -1.442707
H 4.080305 -2.207098 0.831836
H 3.557566 -1.263528 2.273926
H 1.370322 -1.798012 1.811428
H 1.423530 -2.511479 0.182089
H 4.318397 0.511083 -2.221091
H 3.756949 1.443989 -0.775172
H 4.691492 0.770180 1.420887
H 5.876367 -0.599287 1.419392
H 0.804340 1.136946 0.846962
H -3.341853 0.969305 -0.456548
H -2.014937 2.955744 1.333544
H -0.419653 3.166628 0.581234
H -1.827397 -3.308558 -0.516646
H -1.592951 3.300724 -1.731914
H -4.489596 -0.556858 -1.971978
H -5.039097 -0.766595 -0.261196
H -5.194738 -2.130722 -1.434711
H -3.620255 4.708420 -1.564845
H -3.721416 4.376149 0.270858


