%chk=000281236.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281236

0 1
P 1.973836 -0.159170 0.211198
O 2.167612 -0.547084 1.661829
O -0.620380 -0.242492 1.983977
N 2.109698 1.593413 0.026297
N 3.102100 -0.917129 -0.930005
C 0.189806 -0.534872 -0.335392
C -0.687476 0.298394 0.652589
C -0.090761 -2.022127 -0.143989
C -0.009646 -0.120521 -1.786290
C -2.163105 0.255971 0.298894
C 2.472074 2.104368 -1.321105
C 2.938840 2.202069 1.103877
C 3.044417 -2.406288 -0.873226
C 4.497102 -0.441238 -0.680880
C -2.691711 1.195702 -0.598374
C -3.005966 -0.701821 0.880003
C -4.049621 1.159272 -0.927424
C -4.363507 -0.731506 0.551284
C -4.886508 0.194837 -0.356838
H -0.350671 1.365655 0.707031
H -1.142140 -2.242433 -0.385973
H 0.044643 -2.339220 0.903875
H 0.519775 -2.669554 -0.791125
H 0.654007 -0.666190 -2.472309
H 0.143451 0.956150 -1.954487
H -1.037784 -0.343270 -2.113044
H 1.748957 1.734167 -2.073906
H 3.491917 1.844829 -1.662939
H 2.391534 3.206498 -1.320001
H 2.729832 1.719516 2.082922
H 2.649127 3.263249 1.207734
H 4.026269 2.164173 0.934418
H 3.276584 -2.851510 0.110721
H 3.761703 -2.824486 -1.601756
H 2.039916 -2.758916 -1.191581
H 5.195581 -0.996908 -1.332720
H 4.863511 -0.559254 0.354117
H 4.586136 0.621509 -0.980263
H 0.330892 -0.333857 2.303815
H -2.049979 1.958044 -1.034704
H -2.589128 -1.404265 1.606194
H -4.457238 1.887672 -1.625268
H -5.015046 -1.474466 1.007235
H -5.943052 0.169790 -0.613312


%chk=000281236-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281236

0 1
P 2.055154 -0.229065 0.258290
O 2.162914 -0.519986 1.856799
O -0.520355 -0.139657 2.069955
N 2.398213 1.463760 -0.014832
N 3.233400 -0.991860 -0.811274
C 0.230423 -0.656520 -0.280895
C -0.630708 0.290098 0.682244
C -0.083169 -2.139322 0.030835
C 0.018454 -0.311890 -1.768277
C -2.114784 0.315162 0.323655
C 2.615777 2.045159 -1.345398
C 2.446850 2.394171 1.124125
C 3.061968 -2.373001 -1.307076
C 4.652746 -0.643396 -0.551819
C -2.611891 1.221618 -0.646572
C -3.025689 -0.548254 0.982407
C -3.985036 1.243955 -0.978684
C -4.399485 -0.526288 0.653557
C -4.884200 0.363467 -0.333351
H -0.226505 1.321823 0.554774
H -1.178456 -2.261808 0.104681
H 0.355381 -2.458482 0.991212
H 0.273123 -2.812137 -0.766672
H 0.738464 -0.842885 -2.416611
H 0.126863 0.770444 -1.960612
H -1.000639 -0.604475 -2.077622
H 2.666101 1.249135 -2.106524
H 3.576161 2.601494 -1.370665
H 1.807279 2.755737 -1.620092
H 2.331572 1.825019 2.061688
H 1.643427 3.157341 1.062296
H 3.423418 2.920075 1.153841
H 3.256626 -3.142875 -0.529904
H 3.778406 -2.531467 -2.134511
H 2.050893 -2.527476 -1.711607
H 5.213311 -0.678779 -1.505064
H 5.129557 -1.339965 0.168845
H 4.718815 0.377685 -0.141810
H 0.460900 -0.302475 2.276683
H -1.926858 1.924786 -1.136773
H -2.644530 -1.193544 1.779400
H -4.353799 1.953394 -1.728365
H -5.093684 -1.194877 1.175602
H -5.950805 0.382861 -0.584776


