%chk=000196119.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196119

0 1
P 2.235772 -2.928666 0.232221
O 0.189872 1.026410 -1.316452
O 2.926787 2.376990 -0.224269
O 0.637120 3.102770 1.063845
O 1.806479 -1.346999 -0.002216
O 3.296982 2.951414 1.931482
O 3.649218 -2.727859 1.041042
O 1.331948 -3.263134 1.551355
O 2.246721 -3.787989 -0.948090
O -3.909957 -3.644733 0.272699
N -1.119400 0.113327 0.407395
N -3.162547 0.196830 -1.094656
N -1.415342 -2.036761 1.171514
N -4.502422 -1.833219 -1.006708
N 4.203161 5.442965 0.711476
N -5.272876 0.063441 -2.226055
C 1.600158 0.701982 -1.196090
C 2.070143 1.269950 0.160093
C 0.778976 1.698261 0.920322
C -0.385938 1.315445 -0.037452
C 1.843516 -0.820730 -1.361376
C 0.795022 -1.472421 -2.239503
C -2.287136 -0.401591 -0.188351
C -0.617893 -0.967174 1.217829
C -2.468073 -1.714136 0.307740
C 3.525848 3.134450 0.759463
C -3.636795 -2.528228 -0.076095
C 4.463979 4.120228 0.092581
C -4.311696 -0.607560 -1.430378
H 2.049861 1.259053 -2.055552
H 2.685669 0.562429 0.759873
H 0.725951 1.218215 1.921884
H -1.089483 2.165716 -0.222149
H 2.877418 -0.975461 -1.758549
H 0.644932 -0.913946 -3.172390
H 1.065105 -2.506714 -2.519909
H -0.185803 -1.515593 -1.742430
H 1.231268 3.436476 1.792349
H 0.297656 -0.871469 1.789327
H -3.063735 1.168312 -1.369963
H 4.243859 4.174021 -1.003884
H 5.506476 3.737692 0.194125
H 3.595385 -2.745563 2.037981
H 0.363655 -3.525928 1.452613
H 4.655691 6.180525 0.180289
H 4.557277 5.474471 1.665001
H -4.923403 0.555827 -3.040219
H -6.085404 -0.514628 -2.457467


%chk=000196119-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000196119

0 1
P 1.876059 -2.580177 0.262165
O -0.324363 1.234970 -1.270170
O 2.858720 2.290482 -0.335820
O 0.474953 3.488334 0.667154
O 0.878748 -1.397447 -0.545301
O 3.056725 3.026972 1.867789
O 2.682292 -1.410974 1.312031
O 0.786888 -3.386843 1.211508
O 2.893474 -3.390620 -0.641265
O -3.167120 -4.028766 0.666990
N -1.214622 0.232809 0.720137
N -3.058848 -0.171472 -0.922857
N -1.149402 -1.846169 1.624812
N -4.041733 -2.390269 -0.785377
N 5.176773 4.686193 1.124259
N -4.833838 -0.831592 -2.343958
C 1.137906 0.910854 -1.334052
C 1.735463 1.374724 0.016626
C 0.560058 2.046163 0.820187
C -0.697609 1.489343 0.121673
C 1.401693 -0.575742 -1.665810
C 0.739398 -1.041953 -2.964720
C -2.207399 -0.532897 0.107160
C -0.594697 -0.620097 1.636481
C -2.195756 -1.804545 0.681520
C 3.492976 2.977936 0.689459
C -3.133933 -2.850450 0.226600
C 4.776326 3.628182 0.205544
C -3.976808 -1.181446 -1.318111
H 1.541941 1.529786 -2.154826
H 2.163774 0.536600 0.596486
H 0.626605 1.774754 1.888279
H -1.495965 2.248662 0.105455
H 2.503486 -0.700761 -1.734188
H 1.082836 -0.431631 -3.820637
H 0.998094 -2.095516 -3.159636
H -0.356943 -0.953500 -2.886811
H 1.161566 3.893904 1.259013
H 0.289160 -0.356988 2.208802
H -2.830087 0.617111 -1.533492
H 4.600974 4.025621 -0.811186
H 5.508684 2.787572 0.086331
H 3.460723 -1.780817 1.800743
H -0.145583 -2.859537 1.542149
H 6.051047 5.162831 0.906028
H 5.027624 4.482340 2.114275
H -4.985033 0.130377 -2.637459
H -5.471227 -1.559613 -2.659681


