%chk=000264929.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264929

0 1
S -5.559842 0.903088 0.980147
O -0.153002 1.696537 0.126621
O -0.202330 -3.001527 -0.364733
O 4.171663 0.314473 -1.113059
N -1.728931 -1.334198 -0.823226
N 2.235260 0.482674 0.869222
N 3.601877 0.642251 1.148408
N 5.876620 0.643756 0.401471
C -1.876367 0.134475 -0.655167
C -2.987146 0.536820 0.325949
C -0.480167 0.554002 -0.123887
C 0.339199 -0.645812 -0.001571
C -0.477839 -1.816211 -0.379744
C -4.364324 0.417180 -0.309525
C 1.663063 -0.690035 0.383188
C 2.470151 -1.934398 0.364552
C -7.136796 0.749225 0.113766
C 4.528550 0.515600 0.029693
H -2.044415 0.607746 -1.657588
H -2.801101 1.585395 0.657872
H -2.921646 -0.081236 1.247531
H -2.535899 -1.923444 -0.956689
H -4.465405 1.078996 -1.189301
H -4.573533 -0.612896 -0.648554
H 3.208398 -1.916528 -0.459594
H 1.831284 -2.830499 0.162925
H 2.996579 -2.145526 1.301773
H 1.759568 1.404279 0.690150
H -7.932070 1.025549 0.820348
H -7.323540 -0.276039 -0.221508
H -7.200177 1.423026 -0.746834
H 3.869077 0.138187 2.012854
H 6.536440 0.779475 -0.359764
H 6.134501 1.118914 1.254971


%chk=000264929-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264929

0 1
S -5.625791 1.131237 1.044375
O -0.042526 1.679081 0.184312
O -0.290560 -3.100680 -0.568549
O 4.327411 0.297946 -1.182375
N -1.788426 -1.288378 -0.808632
N 2.250099 0.383980 0.729486
N 3.603337 0.494341 1.045464
N 5.866055 0.806554 0.503308
C -1.857760 0.172586 -0.637565
C -2.948967 0.662518 0.348799
C -0.436861 0.495421 -0.126299
C 0.320957 -0.733282 -0.061805
C -0.549033 -1.861114 -0.491891
C -4.369211 0.458132 -0.203371
C 1.671232 -0.798111 0.334750
C 2.483218 -2.062492 0.326527
C -7.204216 0.696201 0.116286
C 4.588698 0.526996 0.029262
H -2.002354 0.682211 -1.614303
H -2.764828 1.736865 0.538580
H -2.835001 0.127482 1.310220
H -2.559860 -1.863080 -1.145517
H -4.505390 0.999465 -1.157888
H -4.593336 -0.613718 -0.358354
H 3.212875 -2.018289 -0.503811
H 1.819071 -2.925952 0.171384
H 3.055898 -2.173034 1.264644
H 1.664869 1.246388 0.622457
H -8.042340 1.037727 0.743541
H -7.276842 -0.393692 -0.030943
H -7.236968 1.216789 -0.854541
H 3.829387 0.658398 2.028144
H 6.618656 0.802091 -0.180604
H 6.076205 1.062714 1.465608


