%chk=000258622.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258622

0 1
P 0.372454 -0.044129 -0.992543
O -0.534354 0.658200 0.209011
O 1.747816 -0.231464 -0.089263
O 0.452768 0.649183 -2.286416
N -0.186180 -1.672513 -1.145611
N -1.055031 -3.713321 -0.407605
C -1.754241 1.210659 -0.207066
C 2.483486 0.956994 0.079898
C -2.936731 0.552374 0.188330
C 3.499474 1.278937 -0.842553
C -0.300291 -2.607688 -0.091825
C -1.759756 2.433802 -0.886804
C 2.240501 1.702459 1.238071
C -4.154619 1.167440 -0.137150
C 4.288240 2.403242 -0.553987
C 0.309296 -2.450230 1.176024
C -2.894846 -0.746082 0.915332
C 3.708975 0.473176 -2.075837
C -0.641286 -4.589221 1.820834
C -2.990870 3.016829 -1.196530
C 3.045662 2.814353 1.493740
C -4.181665 2.385075 -0.823485
C 4.065109 3.160186 0.600033
C 0.126986 -3.451474 2.124000
C -1.207298 -4.675407 0.534983
C -0.839037 -5.671413 2.826334
H -0.570753 -1.997865 -2.060371
H -0.825549 2.916094 -1.176666
H 1.434410 1.415035 1.913790
H -5.089767 0.687358 0.148808
H 5.083642 2.689080 -1.241557
H 0.930586 -1.582135 1.410838
H -2.928756 -1.594271 0.212147
H -1.971187 -0.853547 1.507208
H -3.737405 -0.864299 1.608566
H 4.677352 0.667087 -2.552571
H 3.655489 -0.606880 -1.870847
H 2.926823 0.699046 -2.826342
H -3.018719 3.965320 -1.731090
H 2.876382 3.410907 2.388568
H 0.588907 -3.353930 3.107468
H -5.138120 2.844231 -1.069154
H 4.690420 4.028699 0.802985
H -1.810865 -5.539654 0.232024
H -1.536494 -6.446631 2.482333
H 0.111164 -6.174957 3.059202
H -1.239716 -5.276254 3.770846


%chk=000258622-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258622

0 1
P 0.423058 -0.094896 -1.246057
O -0.611180 0.696554 -0.077199
O 1.819715 -0.182377 -0.230494
O 0.548383 0.572652 -2.682334
N -0.053591 -1.746771 -1.339046
N -0.771673 -3.882578 -0.790456
C -1.935398 1.151795 -0.382842
C 2.591735 0.982624 0.104621
C -2.873040 1.044387 0.678030
C 3.702587 1.315592 -0.712226
C -0.251500 -2.713525 -0.323142
C -2.258569 1.728558 -1.629838
C 2.268463 1.684382 1.282261
C -4.176371 1.543701 0.435709
C 4.499689 2.407945 -0.285109
C 0.063140 -2.502895 1.045227
C -2.483050 0.427289 2.005107
C 4.010363 0.541172 -1.977020
C -0.743538 -4.783636 1.493663
C -3.571549 2.206374 -1.839082
C 3.080946 2.768911 1.679295
C -4.531720 2.116892 -0.806950
C 4.199411 3.129007 0.893173
C -0.194701 -3.552953 1.945889
C -1.001721 -4.883907 0.105414
C -1.032342 -5.932953 2.438264
H -0.280393 -2.091117 -2.278933
H -1.498532 1.801919 -2.414455
H 1.387619 1.385965 1.858681
H -4.921255 1.474684 1.237396
H 5.367436 2.693070 -0.891276
H 0.517470 -1.567012 1.377893
H -2.073994 -0.590312 1.867700
H -1.695754 1.021133 2.506161
H -3.352629 0.366289 2.681247
H 4.935305 0.911339 -2.449921
H 4.132055 -0.536722 -1.764917
H 3.184928 0.633512 -2.707513
H -3.834504 2.652556 -2.804143
H 2.840202 3.326021 2.590841
H 0.041541 -3.419289 3.008251
H -5.548813 2.490796 -0.965752
H 4.834693 3.968959 1.194555
H -1.414201 -5.808288 -0.317068
H -1.440461 -6.803434 1.895980
H -0.117405 -6.263960 2.964385
H -1.768447 -5.645051 3.212131


