%chk=000197248.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197248

0 1
P -3.449060 -1.598797 -0.017780
O -1.392916 0.892969 1.069828
O -3.970660 -0.051786 -0.278694
O -2.299696 3.862141 -0.722688
O -2.553889 -1.542041 1.335612
O -2.253993 -1.669248 -1.176542
O -4.489712 -2.617027 -0.070407
N 0.670474 0.407324 0.025523
N 1.188132 -1.127605 -1.613090
N 2.773351 0.218854 1.383869
N 4.357881 -1.395033 0.444844
N 3.939636 -2.618693 -1.534995
C -0.048173 1.421169 0.812891
C -2.403612 1.687837 0.377905
C -1.595399 2.875167 -0.132932
C -0.277104 2.716466 0.081919
C -3.033442 0.906306 -0.783506
C 1.945174 -0.095807 0.337744
C 0.264963 -0.269795 -1.180383
C 2.254492 -1.044539 -0.696678
C 3.518222 -1.702230 -0.610414
C 3.949055 -0.470063 1.367154
H 0.420883 1.517142 1.827256
H -3.145734 1.933845 1.172336
H 0.546994 3.356908 -0.175085
H -2.263917 0.452987 -1.450200
H -3.683311 1.582984 -1.387247
H -0.715089 -0.092186 -1.622365
H -1.711344 4.614162 -1.021665
H 4.658017 -0.263466 2.188388
H 3.339126 -2.881845 -2.301203
H 4.829924 -3.081139 -1.434146
H -1.800103 -0.862514 1.384620
H -2.078072 -2.531543 -1.620765


%chk=000197248-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000197248

0 1
P -3.263359 -1.718267 0.157496
O -1.305244 0.891653 0.941087
O -4.006438 -0.150223 0.011223
O -2.488372 3.899687 -0.735944
O -2.107357 -1.580160 1.392612
O -2.349767 -1.673182 -1.326597
O -4.281094 -2.905286 0.334137
N 0.810640 0.527098 -0.211182
N 1.481778 -0.897246 -1.882212
N 2.546348 0.001861 1.489363
N 4.136588 -1.696474 0.692276
N 3.997130 -2.690728 -1.446030
C 0.027644 1.482189 0.569839
C -2.420086 1.734650 0.420796
C -1.685307 2.906524 -0.200678
C -0.335755 2.762481 -0.147437
C -3.291010 0.980400 -0.603905
C 1.944164 -0.148439 0.278689
C 0.583656 0.028674 -1.511672
C 2.344344 -1.013496 -0.770288
C 3.499161 -1.813695 -0.522541
C 3.637759 -0.816051 1.611493
H 0.593488 1.626737 1.508832
H -3.035405 2.031689 1.289405
H 0.427088 3.445679 -0.523919
H -2.685492 0.632276 -1.459288
H -4.085649 1.658879 -0.957783
H -0.248839 0.363899 -2.124106
H -1.959704 4.643185 -1.119199
H 4.178507 -0.761556 2.560534
H 3.540658 -2.794317 -2.349774
H 4.822060 -3.238750 -1.209815
H -1.639734 -0.672246 1.390159
H -1.891303 -2.516540 -1.566467


