%chk=000291769.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291769

0 1
O 1.853370 1.589270 -0.147898
O -4.232019 -0.561821 0.890029
O 1.027961 3.691182 0.034036
O 2.197050 -3.089753 1.277720
O -2.681221 -2.003797 0.076092
O 2.602007 -2.210229 -0.766801
N -2.615669 1.582996 0.835418
C -0.768266 0.440657 0.119482
C -0.428451 1.815910 0.295804
C 0.115884 -0.658209 -0.343145
C 3.237682 2.035638 -0.501399
C -1.594628 2.501124 0.737496
C -2.128001 0.306706 0.454275
C 0.842987 2.485984 0.054480
C 1.046483 -1.115399 0.786771
C 3.769033 2.904844 0.629437
C 3.945032 0.688981 -0.599999
C 3.164232 2.765731 -1.835390
C -1.769953 3.927373 1.060399
C -2.964256 -0.880540 0.425874
C 2.012312 -2.151392 0.288096
C -5.238347 -1.623616 0.896963
C 3.091364 -4.215086 1.009135
C -5.779508 -1.826414 -0.502375
C 2.389941 -5.227823 0.128166
H -0.489307 -1.519782 -0.713481
H 0.732360 -0.308732 -1.207895
H -3.569850 1.739394 1.121038
H 0.464693 -1.499827 1.651684
H 1.631520 -0.237991 1.163197
H 3.219797 3.858846 0.689141
H 3.660765 2.414500 1.602933
H 4.828374 3.140981 0.487806
H 3.335883 -0.048940 -1.152747
H 4.140279 0.249895 0.383690
H 4.901581 0.776113 -1.124925
H 4.158617 3.046245 -2.196659
H 2.572050 3.690545 -1.750478
H 2.690201 2.146967 -2.606361
H -2.624418 4.385717 0.543466
H -1.889742 4.101071 2.140382
H -0.866882 4.505284 0.750330
H -5.980748 -1.201333 1.597909
H -4.778706 -2.538959 1.311970
H 4.019074 -3.825924 0.554040
H 3.277220 -4.582821 2.034558
H -6.102889 -0.880381 -0.954139
H -5.012243 -2.255735 -1.165420
H -6.635805 -2.511016 -0.506804
H 1.397521 -5.484167 0.522165
H 2.239561 -4.832507 -0.888092
H 2.967069 -6.154960 0.040627


%chk=000291769-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291769

0 1
O 1.896023 1.677020 -0.098282
O -4.292609 -0.467377 0.882827
O 0.955067 3.825524 -0.137910
O 2.177996 -3.292385 1.232353
O -2.665339 -2.026616 0.206453
O 2.464257 -2.334833 -0.875807
N -2.607547 1.603931 0.806936
C -0.764901 0.470970 0.086326
C -0.445973 1.876068 0.241171
C 0.116677 -0.652320 -0.400458
C 3.308605 2.152386 -0.451400
C -1.621247 2.553821 0.684466
C -2.122118 0.333074 0.449574
C 0.830335 2.573873 -0.016899
C 0.911234 -1.309009 0.758775
C 3.805173 3.144981 0.619348
C 4.108494 0.838619 -0.413943
C 3.289115 2.762914 -1.867144
C -1.863755 3.996202 1.022332
C -2.983682 -0.839706 0.478784
C 1.910300 -2.332362 0.249957
C -5.299029 -1.567309 0.934922
C 3.162118 -4.361036 0.873045
C -5.946919 -1.779860 -0.436535
C 2.459953 -5.519320 0.158426
H -0.508726 -1.425462 -0.878499
H 0.839928 -0.275055 -1.140030
H -3.570799 1.756687 1.106962
H 0.238683 -1.789965 1.488674
H 1.481272 -0.524457 1.293425
H 3.243376 4.090353 0.578855
H 3.700168 2.707536 1.628312
H 4.877178 3.355219 0.447871
H 3.665354 0.082544 -1.084017
H 4.128279 0.423076 0.609302
H 5.149511 1.029560 -0.731712
H 4.321165 3.020446 -2.168092
H 2.676587 3.677705 -1.898202
H 2.890903 2.034741 -2.595660
H -2.801719 4.364054 0.566092
H -1.941349 4.145484 2.116794
H -1.025802 4.603221 0.650038
H -6.026318 -1.224067 1.688741
H -4.794316 -2.485447 1.283683
H 3.949661 -3.917192 0.238539
H 3.580517 -4.666189 1.845745
H -6.403169 -0.845970 -0.808184
H -5.200414 -2.129530 -1.168946
H -6.740665 -2.546340 -0.360289
H 1.631405 -5.913864 0.771353
H 2.058634 -5.189956 -0.814417
H 3.179421 -6.339580 -0.023054


