%chk=000191090.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191090

0 1
P -3.555313 -1.850239 -0.211178
O -1.306547 0.986331 1.128206
O 0.096446 3.781614 1.022300
O -2.066440 3.918524 -0.234957
O -3.621078 -0.266209 -0.579353
O 2.539575 1.588545 -0.395641
O -2.554671 -1.976269 1.104652
O -2.474436 -2.362200 -1.341819
O -4.841833 -2.523584 -0.056115
N 0.826011 0.261909 0.440269
N 2.747263 -0.712046 -0.596263
N 3.103462 -2.949446 -0.877379
C 0.028607 2.687198 0.103112
C -1.388453 2.720623 -0.545881
C 0.044296 1.423942 1.005633
C -2.137302 1.496674 0.044495
C -2.389527 0.390179 -0.983820
C 2.082951 0.478179 -0.194390
C 0.322646 -1.045859 0.694718
C 0.980044 -2.161120 0.300935
C 2.242092 -2.054706 -0.378836
C 3.994402 -0.853765 -1.265807
C 4.181655 -2.215709 -1.422445
H 0.852670 2.744812 -0.639671
H -1.354664 2.722063 -1.657105
H 0.384087 1.632757 2.051126
H -3.084304 1.783373 0.563749
H -1.531406 -0.303138 -1.083572
H -2.647338 0.804737 -1.982783
H 0.713161 4.471378 0.680830
H -1.852449 4.210336 0.698134
H -0.649103 -1.082483 1.227006
H 0.588899 -3.163550 0.486660
H 4.591157 -0.004972 -1.546374
H 5.005661 -2.737328 -1.883624
H -2.975793 -2.097173 1.991998
H -2.294528 -3.332477 -1.418210


%chk=000191090-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191090

0 1
P -3.881964 -1.927779 0.002344
O -1.308249 0.728890 0.942170
O 0.622259 3.452722 -0.504238
O -1.679691 3.861427 0.671111
O -4.059856 -0.236586 0.075398
O 2.617892 1.734253 -0.102627
O -2.451813 -2.371590 0.879557
O -3.238844 -2.082951 -1.579327
O -5.179822 -2.719731 0.425565
N 0.909078 0.143428 0.233306
N 3.087916 -0.555133 -0.310712
N 3.758975 -2.724614 -0.590997
C -0.245000 2.296142 -0.564702
C -1.696441 2.782015 -0.303834
C -0.011489 1.280714 0.598821
C -2.396839 1.563204 0.331153
C -3.205596 0.731344 -0.664577
C 2.224846 0.520806 -0.059146
C 0.470671 -1.194216 0.271689
C 1.335507 -2.233783 0.005847
C 2.700793 -1.940009 -0.298768
C 4.453666 -0.509310 -0.629582
C 4.834495 -1.842589 -0.792460
H -0.171791 1.768941 -1.538254
H -2.184786 3.111354 -1.242678
H 0.434108 1.803199 1.468562
H -3.045078 1.897920 1.157940
H -2.570245 0.202916 -1.396889
H -3.925768 1.379166 -1.194676
H 1.557058 3.099474 -0.368341
H -0.820798 4.350437 0.517474
H -0.579701 -1.341480 0.529508
H 0.995314 -3.268354 0.035275
H 4.989092 0.431641 -0.701930
H 5.822549 -2.222022 -1.043415
H -2.605419 -2.567745 1.839141
H -2.955131 -2.991200 -1.849108


