%chk=000195903.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195903

0 1
P 1.718876 -2.069614 -0.356557
O 1.255381 2.364209 -1.297171
O -1.710903 3.330330 2.300488
O 1.086158 -1.953670 1.163310
O 3.253299 -2.558583 0.020010
O -1.407257 4.978283 0.817374
O 0.991433 -2.958535 -1.287202
N 0.029828 1.897042 0.572984
N 1.915616 -0.442735 -0.865037
N -1.386713 -1.501500 -1.557001
C 2.113944 0.596657 0.171029
C 3.558977 1.160979 0.292753
C -1.147874 2.634071 0.073468
C -2.411555 1.746868 -0.043178
C 1.125548 1.697666 -0.287958
C -2.089734 0.345730 -0.410688
C 4.161451 1.541446 -1.059412
C 4.447390 0.158092 1.030720
C -2.271287 -0.802775 0.441944
C -1.816284 -1.946646 -0.299817
C -1.540246 -0.106495 -1.607481
C -1.412875 3.794332 1.038200
C -2.759973 -0.989601 1.750878
C -1.830099 -3.247880 0.250266
C -2.771121 -2.265385 2.283077
C -2.310411 -3.385982 1.537570
H 1.816909 0.209875 1.189534
H 3.484382 2.092715 0.914153
H -0.896881 3.086025 -0.936007
H -3.098981 2.193171 -0.794089
H -2.975276 1.758436 0.917458
H -0.169374 1.237799 1.327787
H 4.421155 0.667759 -1.665062
H 3.465466 2.165955 -1.645145
H 5.081255 2.123335 -0.929344
H 4.560602 -0.785884 0.476617
H 5.456277 0.560720 1.177333
H 4.050357 -0.097994 2.019047
H 2.445573 -0.241935 -1.736380
H -1.249150 0.463312 -2.475069
H -0.900375 -2.075997 -2.235167
H -3.120278 -0.135548 2.321008
H -1.474467 -4.093635 -0.335276
H -3.145304 -2.433656 3.291339
H -2.348521 -4.370541 2.002871
H -1.861322 4.067247 2.951765
H 0.123885 -2.220125 1.277948
H 3.391598 -3.516540 0.225110


%chk=000195903-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000195903

0 1
P 1.926814 -2.282075 -0.840100
O 0.932979 1.687023 -1.699176
O -1.021910 3.724508 2.127069
O 1.411546 -2.531355 0.780259
O 3.518633 -2.930871 -0.811479
O -2.025554 4.946786 0.419164
O 1.004729 -2.953436 -1.969012
N -0.001916 1.916220 0.421762
N 2.189090 -0.604522 -0.932672
N -1.451723 -1.522075 -1.483083
C 1.937321 0.388623 0.130283
C 3.241625 1.097357 0.632746
C -1.143831 2.694856 -0.060858
C -2.485307 1.830576 -0.150925
C 0.918333 1.390936 -0.460837
C -2.205536 0.382589 -0.454707
C 4.024114 1.777588 -0.512695
C 4.129484 0.084907 1.391685
C -2.245292 -0.708955 0.504812
C -1.757190 -1.886710 -0.171138
C -1.709751 -0.158038 -1.645623
C -1.427535 3.918231 0.793647
C -2.615711 -0.811286 1.872963
C -1.623969 -3.137680 0.480250
C -2.482538 -2.051174 2.530572
C -1.993947 -3.202490 1.844191
H 1.485176 -0.140786 0.989650
H 2.907339 1.881878 1.346293
H -0.884156 3.032600 -1.078287
H -3.123262 2.309900 -0.914268
H -3.025785 1.905766 0.810897
H 0.005496 1.631901 1.403390
H 4.396690 1.019690 -1.225770
H 3.403703 2.500375 -1.070750
H 4.900496 2.313553 -0.105431
H 4.455503 -0.727162 0.716759
H 5.032163 0.585542 1.787203
H 3.591527 -0.376657 2.240763
H 2.250446 -0.189874 -1.870219
H -1.475963 0.344238 -2.582289
H -0.843035 -2.093072 -2.088005
H -3.002035 0.059106 2.416792
H -1.304708 -4.031770 -0.066373
H -2.763165 -2.139650 3.585725
H -1.914446 -4.155424 2.378689
H -1.269622 4.521681 2.668730
H 0.429225 -2.727366 0.873705
H 3.554554 -3.913202 -0.941305


