%chk=000243336.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243336

0 1
P 0.970799 -0.626706 -0.614398
O 1.546247 -2.190910 -0.450375
O 0.577580 -0.340475 -2.030774
O -0.397430 -0.653000 1.762452
N -1.693922 -0.656654 -0.155292
C -3.808865 0.627997 0.203403
C -3.012877 -0.643258 0.527853
C -4.378428 0.626523 -1.221278
C -0.525964 -0.634642 0.553579
C 2.227040 0.414677 0.189286
C -5.218919 1.872336 -1.490139
C 2.420097 0.353588 1.569371
C 2.993339 1.253056 -0.623598
C 3.412720 1.153478 2.149633
C 3.981105 2.049512 -0.035101
C 4.189632 1.995968 1.348599
H -3.173510 1.523510 0.356462
H -4.635013 0.727972 0.936064
H -3.576325 -1.554100 0.224910
H -2.849319 -0.719606 1.631181
H -4.993764 -0.280674 -1.381985
H -3.555114 0.569987 -1.960776
H -1.719899 -0.541355 -1.174490
H -4.630506 2.790255 -1.374820
H -5.617395 1.867520 -2.511461
H -6.072539 1.942306 -0.806344
H 1.804867 -0.293552 2.210567
H 2.836847 1.305212 -1.706309
H 3.576368 1.118109 3.225578
H 4.587461 2.710063 -0.652120
H 1.476508 -2.739884 -1.279914
H 4.962077 2.616746 1.803639


%chk=000243336-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243336

0 1
P 0.928494 -0.931269 -0.413512
O 1.808452 -2.388925 -0.021683
O 0.438617 -0.729805 -1.939081
O -0.605652 -1.132439 1.968828
N -1.758809 -0.851676 -0.077385
C -3.831546 0.548135 0.187423
C -3.139189 -0.809923 0.443543
C -4.020325 0.885478 -1.310391
C -0.657567 -0.991449 0.718913
C 2.135841 0.312675 0.209589
C -4.780587 2.212242 -1.522758
C 2.768497 0.149581 1.463753
C 2.392040 1.441601 -0.602921
C 3.671967 1.140016 1.908233
C 3.299684 2.424260 -0.149564
C 3.936383 2.274512 1.104883
H -3.252320 1.350830 0.684147
H -4.824638 0.518356 0.680107
H -3.723086 -1.623225 -0.031579
H -3.078001 -1.018974 1.525645
H -4.571363 0.058533 -1.803959
H -3.032792 0.951019 -1.810369
H -1.572096 -0.746327 -1.087983
H -4.235656 3.058444 -1.064155
H -4.908545 2.435332 -2.597364
H -5.785921 2.171320 -1.062822
H 2.562834 -0.735010 2.073969
H 1.896544 1.532346 -1.576244
H 4.168252 1.026447 2.877791
H 3.510904 3.299626 -0.772964
H 1.323282 -3.226814 -0.233233
H 4.639201 3.039082 1.454546


