%chk=000195691.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195691

0 1
P -5.803378 -2.472349 0.234153
O -3.035277 1.229942 -1.023363
O -5.413011 -0.930932 -0.205780
O -4.646138 3.444697 0.188927
O -7.211678 -2.597126 -0.598260
O -6.442730 -2.292271 1.727725
O -4.744693 -3.463801 0.063723
O 8.418857 0.070598 0.359427
N -0.961767 0.577851 -0.135104
N 3.008562 -0.197503 -0.637978
N 0.388197 1.663093 1.377154
N 0.797389 -0.630864 -1.447633
N 3.652608 1.152575 1.138892
C -4.234470 -0.334109 0.378751
C -2.164915 0.103273 -0.868854
C -2.925484 -0.981325 -0.092974
C -4.245135 1.089943 -0.228763
C -4.269505 2.218550 0.810032
C 0.357861 0.220782 -0.435226
C 1.182802 0.900437 0.519424
C -0.879588 1.464899 0.977947
C 2.598264 0.709087 0.451336
C 4.425406 -0.274724 -0.562146
C 2.106956 -0.813918 -1.520961
C 4.798412 0.570438 0.546367
C 5.378874 -0.969206 -1.319125
C 6.146285 0.718823 0.897492
C 6.710253 -0.820420 -0.969467
C 7.068278 0.014989 0.124749
H -4.345202 -0.340627 1.485652
H -1.859644 -0.183572 -1.908186
H -2.340295 -1.395124 0.753136
H -3.102307 -1.869764 -0.742383
H -5.072274 1.210378 -0.973836
H -3.284254 2.339665 1.310873
H -5.063896 2.068075 1.568624
H -1.765898 1.925873 1.407889
H 2.520862 -1.473784 -2.299659
H -3.980288 3.694327 -0.495623
H 5.084220 -1.603143 -2.152408
H 6.427549 1.355126 1.731743
H -7.187633 -2.792959 -1.567497
H -7.403912 -2.019668 1.776724
H 7.504874 -1.330015 -1.513369
H 8.641364 0.658883 1.125557


%chk=000195691-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000195691

0 1
P -6.379146 -1.774666 1.100253
O -2.635693 0.563587 -1.450504
O -5.631634 -0.693691 -0.037072
O -3.354971 3.274840 -0.850551
O -7.856964 -2.072628 0.284438
O -7.009380 -0.809288 2.355078
O -5.446776 -2.956776 1.581134
O 8.387295 0.900877 0.467428
N -0.945591 -0.456376 -0.006354
N 3.020837 -0.039118 -0.703811
N 0.251734 0.041124 1.891011
N 0.883779 -0.506580 -1.671087
N 3.521845 0.433946 1.524060
C -4.198178 -0.356452 0.177757
C -2.055096 -0.698689 -0.946412
C -3.240077 -1.464786 -0.328017
C -3.893643 0.876157 -0.703813
C -3.687831 2.189260 0.065731
C 0.395845 -0.332604 -0.396406
C 1.117043 -0.025494 0.788938
C -0.965837 -0.217029 1.378164
C 2.532247 0.144837 0.670024
C 4.419280 0.161704 -0.638211
C 2.202388 -0.352267 -1.781557
C 4.695709 0.450355 0.740934
C 5.432207 0.120119 -1.616201
C 6.022021 0.705988 1.155818
C 6.749323 0.375058 -1.195089
C 7.033477 0.663699 0.173245
H -4.048375 -0.139481 1.253620
H -1.604091 -1.190016 -1.822552
H -2.952282 -2.184283 0.452836
H -3.754985 -2.014129 -1.134587
H -4.687128 1.002647 -1.461613
H -2.898642 2.057698 0.838019
H -4.627862 2.491110 0.558772
H -1.873939 -0.270992 1.973399
H 2.678630 -0.474956 -2.756865
H -2.570240 2.984807 -1.385128
H 5.226272 -0.099446 -2.668725
H 6.234112 0.927015 2.207511
H -7.821186 -2.608242 -0.546044
H -7.925481 -0.464556 2.192438
H 7.583316 0.358804 -1.901880
H 8.512165 1.094014 1.429575


