%chk=000273348.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273348

0 1
O 1.052400 0.610696 -0.119209
O 0.366480 0.048870 1.990770
O -2.512658 0.574987 -1.745707
O 6.586464 -2.349673 0.353905
O 6.642550 -1.669574 -1.698270
N -2.211230 0.484129 0.512486
N 6.101743 -1.775262 -0.608605
C -0.421161 3.848393 1.053326
C -1.281601 2.616758 1.416843
C -1.070314 1.415368 0.483343
C 1.076782 3.559081 1.179166
C -0.763795 4.373359 -0.344145
C 0.151621 0.607701 0.953542
C -2.871005 0.117372 -0.677706
C -4.007593 -0.833465 -0.481709
C 2.283770 -0.023577 -0.129543
C -5.256349 -0.502199 -1.025556
C -3.825401 -2.048211 0.192489
C 2.860052 -0.685679 0.961342
C 2.925923 0.078351 -1.381245
C -6.330424 -1.383694 -0.875771
C -4.902819 -2.926968 0.333666
C 4.117585 -1.261777 0.797217
C 4.178158 -0.498889 -1.533429
C 4.772164 -1.166385 -0.442827
C -6.154339 -2.593642 -0.196095
H -0.680753 4.647553 1.797267
H -1.093182 2.330874 2.471330
H -2.351802 2.913603 1.377683
H -0.904227 1.769740 -0.584434
H 1.326393 3.103828 2.143520
H 1.662932 4.482623 1.098074
H 1.437336 2.890456 0.387078
H -1.819994 4.652299 -0.425673
H -0.170706 5.261395 -0.591253
H -0.564390 3.627661 -1.125170
H -2.536957 0.173802 1.424832
H -5.382345 0.434994 -1.570898
H -2.847652 -2.316112 0.593690
H 2.337081 -0.755158 1.920709
H 2.430712 0.598849 -2.202025
H -7.303508 -1.129753 -1.295171
H -4.765938 -3.874561 0.853781
H 4.602825 -1.789597 1.627635
H 4.712293 -0.444143 -2.489939
H -6.992921 -3.281021 -0.083117


%chk=000273348-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000273348

0 1
O 1.065697 0.636039 -0.271311
O 0.379233 0.200516 1.943830
O -2.892777 0.870733 -1.702783
O 6.638573 -2.498812 0.273997
O 6.689032 -1.842328 -1.910943
N -2.195459 0.482212 0.482308
N 6.123530 -1.904905 -0.751066
C -0.456571 3.925096 1.148429
C -1.374048 2.682794 1.335389
C -1.094252 1.461208 0.415077
C 1.011345 3.680910 1.578880
C -0.528538 4.494168 -0.289666
C 0.175952 0.709157 0.822830
C -3.022988 0.234365 -0.610156
C -4.087153 -0.813554 -0.412690
C 2.319895 -0.034337 -0.272459
C -5.191572 -0.798631 -1.302633
C -4.016443 -1.816318 0.590423
C 2.906022 -0.692892 0.838109
C 2.967099 0.014667 -1.531022
C -6.220684 -1.754447 -1.178199
C -5.045307 -2.775703 0.711105
C 4.162645 -1.307394 0.668758
C 4.218849 -0.598812 -1.695702
C 4.802533 -1.254421 -0.587374
C -6.152762 -2.743194 -0.167815
H -0.873149 4.694948 1.831909
H -1.331186 2.347775 2.391776
H -2.418873 2.983344 1.126052
H -1.024296 1.771242 -0.639290
H 1.070228 3.226407 2.585133
H 1.568733 4.635120 1.602728
H 1.538880 3.016916 0.868684
H -1.573912 4.670155 -0.603876
H 0.013876 5.455201 -0.353764
H -0.066760 3.807148 -1.023172
H -2.385408 0.046811 1.386817
H -5.213242 -0.033320 -2.085238
H -3.147646 -1.888422 1.256300
H 2.394514 -0.725377 1.799721
H 2.472475 0.530469 -2.358368
H -7.072138 -1.732152 -1.866901
H -4.978439 -3.552415 1.480557
H 4.651532 -1.826639 1.497101
H 4.745674 -0.581864 -2.652741
H -6.950513 -3.488064 -0.072547


