%chk=000192218.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192218

0 1
P 2.771039 1.272788 0.507540
P 2.540910 -1.501594 1.625588
O -1.086155 2.651043 -2.052377
O -2.524827 4.608580 0.042240
O -0.025197 4.803607 0.131270
O 2.260669 1.840183 -0.908538
O 2.126477 -0.260847 0.584870
O 1.839530 2.075482 1.588495
O 4.211346 1.180398 0.782822
O 4.130312 -1.657616 1.304946
O 2.079815 -1.169456 2.977405
N -2.564445 1.138417 -1.012455
N -3.214199 -0.996895 -1.599872
N -1.345701 0.564740 1.116481
N -1.338666 -1.837303 1.576799
N -2.446202 -3.422213 0.207693
N 1.885137 -2.909449 0.890789
N 0.528701 -4.687345 0.504067
C -1.934721 3.325822 0.096336
C -0.379618 3.414242 0.119770
C -2.259017 2.566126 -1.223147
C 0.104400 2.894801 -1.249557
C 0.865456 1.562718 -1.247159
C -2.078633 0.280007 -0.012469
C -3.238171 0.284775 -1.962865
C -2.493979 -1.042007 -0.392427
C -2.095316 -2.125000 0.450847
C -1.026517 -0.535956 1.853465
C 2.237595 -3.442276 -0.382753
C 0.823011 -3.730193 1.388374
C 1.400428 -4.521986 -0.595530
H -2.376941 2.857288 1.004736
H 0.060003 2.885507 0.994979
H -3.065154 3.044291 -1.831237
H 0.664680 3.684824 -1.806494
H 0.939702 1.167620 -2.285610
H 0.407627 0.788261 -0.603791
H -1.924858 5.248771 -0.440982
H 0.003863 5.135833 1.057863
H -3.702672 0.695101 -2.850145
H -0.431515 -0.369333 2.773647
H 1.874767 1.797041 2.546886
H -2.014271 -4.178162 0.731531
H -2.892850 -3.662614 -0.667480
H 3.027958 -3.031645 -0.987287
H 0.341383 -3.554795 2.349963
H 4.698460 -0.804558 1.284395
H 1.351554 -5.195526 -1.434424


%chk=000192218-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000192218

0 1
P 2.873129 1.326731 0.316019
P 2.775999 -1.384499 1.467264
O -1.263296 2.697192 -2.108551
O -2.306722 4.844046 -0.116642
O 0.164342 4.435840 0.707316
O 2.287730 2.133734 -1.034774
O 2.331059 -0.356991 0.093547
O 1.904446 1.886727 1.615626
O 4.444536 1.329001 0.556077
O 4.472524 -1.440102 1.396270
O 2.074975 -0.760970 2.759398
N -2.910204 1.313523 -0.979569
N -4.039673 -0.628591 -1.490588
N -1.443419 0.428752 0.843697
N -1.791772 -1.969010 1.233329
N -3.349469 -3.253335 0.004887
N 2.365283 -3.009895 1.016232
N 1.167665 -4.895640 0.658460
C -1.984755 3.436558 0.078630
C -0.443265 3.235912 0.131900
C -2.427533 2.691162 -1.196671
C -0.024771 3.030472 -1.345591
C 0.914565 1.843363 -1.601017
C -2.408160 0.323422 -0.118372
C -3.878737 0.672225 -1.779524
C -3.119570 -0.860331 -0.450249
C -2.766747 -2.046955 0.262097
C -1.205859 -0.757484 1.473635
C 3.262117 -3.953793 0.437891
C 1.096515 -3.649245 1.124528
C 2.504457 -5.094046 0.235845
H -2.476422 3.042123 0.987387
H -0.225581 2.345456 0.737916
H -3.232882 3.248865 -1.701626
H 0.394271 3.966403 -1.754219
H 1.101803 1.714667 -2.677642
H 0.511522 0.911246 -1.168749
H -1.568558 5.359752 0.314144
H 0.858836 4.160138 1.355646
H -4.422909 1.211756 -2.552313
H -0.447353 -0.741556 2.263509
H 1.837660 1.199996 2.355794
H -3.040042 -4.076067 0.519868
H -4.057443 -3.329575 -0.722989
H 4.305772 -3.710781 0.265664
H 0.197232 -3.157651 1.499086
H 4.881356 -0.533923 1.213731
H 2.822548 -6.047125 -0.179113


