%chk=000258624.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258624

0 1
P 1.498888 0.362015 0.260009
O 1.612542 1.991194 0.196662
O 2.758887 -0.119673 -0.692958
O 1.409390 -0.132827 1.642851
N 0.195754 -0.095018 -0.808681
N -2.046622 -0.274554 -1.447898
C -1.152454 -0.211937 -0.404598
C 1.572461 2.693462 -1.071308
C 3.378372 -1.394743 -0.361484
C -1.566629 -0.279223 0.948316
C -3.856080 -0.468648 0.162329
C -2.924678 -0.404650 1.214872
C -3.364351 -0.404833 -1.153860
C 2.837192 2.477925 -1.878361
C 4.180274 -1.312579 0.922037
C -5.314839 -0.603985 0.438015
H 0.350869 -0.178392 -1.831894
H 0.653164 2.428670 -1.625391
H 1.486968 3.741816 -0.710188
H 2.610222 -2.190209 -0.336261
H 4.028658 -1.540000 -1.249479
H -0.844526 -0.254026 1.772010
H -3.268717 -0.457748 2.248735
H -4.036286 -0.455240 -2.018583
H 2.892415 3.170573 -2.726004
H 3.733378 2.636198 -1.259991
H 2.923204 1.456615 -2.280644
H 4.834168 -2.184334 1.039727
H 4.814544 -0.416040 0.946741
H 3.536949 -1.268489 1.819317
H -5.918695 -0.623034 -0.478561
H -5.532390 -1.532509 0.985864
H -5.685131 0.231523 1.049659


%chk=000258624-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258624

0 1
P 1.425731 -0.442243 0.361464
O 1.544287 1.277890 0.526448
O 2.617923 -0.991244 -0.773894
O 1.476760 -1.108655 1.799733
N 0.074252 -0.726471 -0.692309
N -2.137992 -0.820600 -1.419885
C -1.288346 -0.496865 -0.404865
C 1.346283 2.187247 -0.641559
C 3.851104 -1.630769 -0.219202
C -1.736561 0.022184 0.841133
C -4.034046 -0.114151 -0.024409
C -3.119195 0.210699 1.014955
C -3.473481 -0.629720 -1.217096
C 2.639235 2.384591 -1.437346
C 4.824954 -0.601099 0.359473
C -5.530132 0.071908 0.132619
H 0.256133 -1.197911 -1.583695
H 0.530209 1.796789 -1.279820
H 1.012027 3.125503 -0.167686
H 3.553520 -2.373780 0.543920
H 4.270833 -2.149261 -1.096640
H -1.030595 0.249841 1.645509
H -3.492770 0.605380 1.967233
H -4.120991 -0.908280 -2.057809
H 2.478228 3.145089 -2.224872
H 3.450109 2.737206 -0.776707
H 2.957884 1.443868 -1.917719
H 5.760102 -1.107253 0.664527
H 5.075380 0.169951 -0.389175
H 4.399274 -0.107651 1.250752
H -6.070176 -0.250053 -0.774754
H -5.923328 -0.515787 0.983260
H -5.789718 1.130949 0.319419


