%chk=000236445.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236445

0 1
P 0.241147 -0.385534 -0.666083
O 0.479642 -0.227773 -2.137200
N 0.273096 -2.068652 -0.158343
N -1.315932 0.228163 -0.098170
N 1.479680 0.469596 0.258728
N 2.988083 -2.361542 0.588341
N -4.085640 1.051348 -0.159923
N 1.163173 3.340868 0.981425
C 0.525454 -2.362653 1.280850
C 1.111397 -2.901439 -1.066856
C -1.759376 1.367726 -0.970362
C -2.415172 -0.781624 0.024737
C 2.135668 1.553282 -0.530358
C 1.162656 0.893467 1.651152
C 1.982460 -2.797387 1.590602
C 2.632998 -2.822501 -0.784870
C -2.983334 2.048810 -0.323081
C -3.638379 -0.101351 0.680929
C 1.411017 2.912406 -0.423879
C 0.470094 2.270571 1.752024
H -0.166464 -3.194033 1.555938
H 0.235822 -1.498349 1.924902
H 0.903483 -2.625719 -2.130383
H 0.764034 -3.953737 -0.949538
H -2.026596 1.042484 -2.005248
H -0.932253 2.121258 -1.063689
H -2.088022 -1.627881 0.667372
H -2.723287 -1.209848 -0.958137
H 2.224642 1.249281 -1.604127
H 3.179148 1.647386 -0.151879
H 2.131174 0.920910 2.204242
H 0.538521 0.115578 2.155308
H 2.294957 -2.408563 2.582162
H 2.031902 -3.907143 1.659459
H 3.083924 -3.830577 -0.921318
H 3.129998 -2.157364 -1.523450
H -2.681600 2.526175 0.634888
H -3.353538 2.854868 -0.993676
H -4.478450 -0.827302 0.733167
H -3.384646 0.192710 1.722101
H 1.994709 3.703573 -0.938680
H 0.420741 2.869427 -0.948679
H -0.580980 2.204154 1.385816
H 0.403359 2.588231 2.813438
H 3.058345 -1.332776 0.598821
H -4.889044 1.505907 0.288880
H 2.061692 3.553972 1.431648


%chk=000236445-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000236445

0 1
P 0.163153 -0.242095 -0.841969
O 0.605226 -0.219091 -2.386312
N 0.488259 -1.825309 -0.170475
N -1.507414 0.044146 -0.385909
N 0.960234 1.054852 0.032528
N 2.952446 -2.616782 0.657141
N -4.228275 0.552196 0.247094
N 1.969103 3.613536 0.951533
C 0.552807 -2.091967 1.281489
C 1.066226 -2.876901 -1.031097
C -2.134377 1.334881 -0.778745
C -2.488033 -1.070841 -0.376377
C 2.269099 1.534276 -0.467459
C 0.603019 1.523700 1.388185
C 1.860574 -2.898854 1.612646
C 2.594689 -3.055146 -0.721970
C -3.262107 1.669810 0.217037
C -3.606009 -0.733408 0.629279
C 2.316983 3.082316 -0.390987
C 0.678519 3.074404 1.441124
H -0.341686 -2.656374 1.631336
H 0.562757 -1.127861 1.821284
H 0.913160 -2.588990 -2.084852
H 0.518895 -3.825065 -0.848143
H -2.563106 1.261810 -1.800517
H -1.365779 2.126788 -0.777230
H -1.971689 -2.002546 -0.091324
H -2.940134 -1.205678 -1.382591
H 2.388582 1.188445 -1.510216
H 3.099658 1.110933 0.147366
H 1.311359 1.107449 2.144914
H -0.415322 1.171308 1.632269
H 2.193448 -2.669798 2.641108
H 1.653969 -3.985034 1.574190
H 2.872700 -4.120967 -0.846477
H 3.197273 -2.465216 -1.435070
H -2.798374 1.870611 1.216299
H -3.781816 2.588298 -0.112705
H -4.375202 -1.527408 0.603436
H -3.155169 -0.712084 1.653465
H 3.323307 3.445630 -0.669703
H 1.592411 3.491676 -1.120476
H -0.127440 3.492127 0.806798
H 0.511538 3.425445 2.476711
H 3.203591 -1.617864 0.671095
H -5.078658 0.766188 0.781022
H 2.727911 3.452856 1.630257


