%chk=000285625.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285625

0 1
S -0.657277 -0.144703 0.344186
O 0.020649 0.891713 1.129498
O -0.518627 -1.529709 0.746422
O 1.983560 -0.693442 -2.331704
N 2.186745 0.769264 -0.581125
N -6.379900 1.225042 -0.127903
C 5.700062 -0.169781 0.765960
C 4.162879 -0.124697 0.643488
C 3.670562 0.691470 -0.559823
C 6.291679 1.222413 1.020532
C 6.349784 -0.822943 -0.459319
C -0.048733 0.026998 -1.307233
C 1.459172 -0.036611 -1.446920
C -2.316686 0.252596 0.207842
C -3.264465 -0.750019 -0.050345
C -2.746034 1.573847 0.407033
C -4.614151 -0.447265 -0.150356
C -4.088329 1.909944 0.314006
C -5.039392 0.895922 0.025403
H 5.932792 -0.808612 1.658221
H 3.772717 -1.160432 0.568784
H 3.733954 0.283717 1.579900
H 4.065250 1.730710 -0.521875
H 4.030331 0.233908 -1.512729
H 6.154856 1.887639 0.161562
H 5.824745 1.702818 1.886771
H 7.367853 1.163487 1.215620
H 5.900022 -1.798616 -0.677059
H 7.421988 -0.980181 -0.303454
H 6.238722 -0.208875 -1.359481
H -0.399217 0.967035 -1.782373
H -0.462576 -0.766995 -1.973596
H 1.744450 1.223250 0.237000
H -2.935496 -1.790864 -0.165560
H -2.010183 2.351466 0.649641
H -5.337306 -1.230612 -0.357709
H -4.407775 2.936968 0.463775
H -6.713436 2.134294 0.142193
H -7.077090 0.502353 -0.180371


%chk=000285625-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000285625

0 1
S -0.689359 -0.114770 0.377187
O 0.036464 1.157800 1.158617
O -0.571778 -1.641205 0.948399
O 2.135267 -0.636546 -2.511753
N 2.236275 0.634700 -0.539426
N -6.576696 1.254593 -0.055576
C 5.839081 -0.228252 0.705638
C 4.289380 -0.257893 0.578439
C 3.707385 0.711295 -0.480322
C 6.367452 1.146793 1.185187
C 6.545912 -0.671379 -0.599339
C 0.050775 -0.086220 -1.445650
C 1.584826 -0.063300 -1.518016
C -2.500515 0.317277 0.213422
C -3.429978 -0.736205 0.129860
C -2.883013 1.671379 0.238683
C -4.795931 -0.419290 0.038361
C -4.250194 1.983309 0.147208
C -5.226658 0.944108 0.037982
H 6.094672 -0.971744 1.490107
H 3.963442 -1.284042 0.319260
H 3.841636 -0.019636 1.564682
H 3.990480 1.754561 -0.248039
H 4.087892 0.463010 -1.485122
H 6.218297 1.928878 0.416972
H 5.854525 1.473356 2.109432
H 7.451715 1.097105 1.397048
H 6.160713 -1.645510 -0.953868
H 7.635727 -0.772413 -0.439850
H 6.398070 0.064897 -1.411623
H -0.400288 0.814336 -1.895287
H -0.338841 -1.005217 -1.906495
H 1.667745 1.020152 0.241839
H -3.088277 -1.776266 0.164242
H -2.128731 2.455771 0.361077
H -5.537421 -1.223806 -0.025586
H -4.571516 3.030954 0.169396
H -6.894130 2.219778 -0.040278
H -7.278307 0.522139 -0.117905


