%chk=000189963.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189963

0 1
P -1.837396 0.157459 -0.914249
O -1.233633 -1.454589 -0.359375
O -2.064034 1.212810 0.299844
O -3.350182 -0.543395 -0.887161
O -1.438369 0.613206 -2.245473
N 2.533024 -0.197854 0.482827
N 0.267260 0.127407 -0.186963
C 1.795619 2.100596 -0.151422
C 1.516191 0.620671 0.056112
C 0.880310 2.923710 0.757681
C 1.597349 2.439397 -1.630264
C 2.295763 -1.535014 0.648449
C 0.044460 -1.233615 -0.031874
C 1.030634 -2.115394 0.395696
C 3.438034 -2.371132 1.107924
C -2.938716 0.833492 1.405233
C -2.252415 -0.147453 2.335611
H 2.865426 2.299358 0.129352
H -0.184646 2.722326 0.553819
H 1.038872 3.996949 0.604098
H 1.058262 2.706978 1.815977
H 2.286355 1.878717 -2.271787
H 1.759874 3.506155 -1.816562
H 0.575562 2.203088 -1.976061
H 0.843013 -3.176168 0.512868
H 3.197287 -2.909538 2.036569
H 3.710455 -3.123076 0.350860
H 4.342719 -1.768318 1.303368
H -3.087355 1.826541 1.878960
H -3.906398 0.456977 1.018159
H -2.774233 -0.207323 3.298871
H -2.222470 -1.167725 1.924272
H -1.216038 0.153864 2.541932
H -3.545886 -1.232408 -1.560695


%chk=000189963-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189963

0 1
P -2.256196 -0.080443 -0.927750
O -1.159428 -1.352602 -0.267767
O -2.615310 1.050913 0.290597
O -3.666856 -1.068823 -0.829043
O -1.900775 0.487059 -2.355732
N 2.765345 -0.187322 0.399711
N 0.479812 0.311400 -0.199332
C 2.128234 2.141340 -0.195032
C 1.782894 0.679879 0.019636
C 1.278179 3.045130 0.736340
C 1.910273 2.520566 -1.685237
C 2.424041 -1.513603 0.565889
C 0.165907 -0.988886 -0.039690
C 1.103324 -1.971363 0.348273
C 3.536533 -2.443309 0.984260
C -3.450655 0.706007 1.492492
C -2.640152 -0.032456 2.558437
H 3.197995 2.248925 0.059470
H 0.202741 2.903483 0.529370
H 1.532558 4.106777 0.565184
H 1.464118 2.814849 1.801551
H 2.551054 1.915424 -2.351981
H 2.159157 3.585659 -1.842894
H 0.856919 2.357067 -1.974004
H 0.818183 -3.017942 0.465460
H 3.183984 -3.480695 1.103376
H 4.347229 -2.422491 0.234151
H 3.977686 -2.099955 1.936946
H -3.769664 1.704018 1.834950
H -4.327271 0.124744 1.159716
H -3.260859 -0.159750 3.465436
H -2.334788 -1.033661 2.208844
H -1.738615 0.540952 2.834362
H -3.720899 -1.794190 -1.499394


