%chk=000193002.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193002

0 1
P 1.108596 2.728893 -0.245406
P 1.929926 0.349121 -1.573131
O -2.581500 2.108797 0.192349
O -3.700100 1.749020 3.254155
O -5.185323 0.719492 1.505240
O 0.001384 2.960214 0.905952
O 1.872094 -0.831014 1.497260
O 2.771855 -0.656249 -0.643000
O 0.797568 1.112514 -0.669112
O 5.320235 -0.933911 0.260449
O -1.656440 -1.084040 0.866104
O 2.460729 2.569031 0.692194
O 2.438552 -4.343779 1.929839
O 1.160729 3.676521 -1.358628
O 2.843789 1.762156 -1.552072
O 1.591560 -0.230444 -2.870652
N -2.563831 0.032074 -0.933326
N -0.784625 -1.634295 -1.200392
N -0.043759 -2.241983 -3.348291
C -2.898787 1.019108 2.318656
C -3.836733 0.358913 1.265409
C -2.088372 2.093840 1.558922
C -3.382050 0.955605 -0.096211
C -0.582854 1.803270 1.570934
C -2.544179 0.260628 -2.309931
C 4.228603 -1.360063 1.061280
C -1.628280 -0.946659 -0.345740
C 3.002713 -0.448920 0.790119
C 3.872793 -2.820905 0.803973
C 1.427973 -2.224076 1.447095
C 2.581177 -3.236673 1.470211
C -1.729101 -0.463544 -3.133514
C 0.532690 -2.337459 2.664449
C -0.835174 -1.432506 -2.545633
H -2.274291 0.269862 2.847497
H -3.840977 -0.753919 1.294987
H -2.304186 3.130868 1.915591
H -4.241617 1.352043 -0.691644
H -0.171771 1.831663 2.601331
H -0.329850 0.830656 1.095558
H -4.214673 1.122866 3.817401
H -5.246605 1.672063 1.795567
H -3.213866 1.037725 -2.705368
H 4.600201 -1.194072 2.102680
H 3.147111 0.629492 1.041164
H 3.773236 -3.004259 -0.290578
H 4.704720 -3.484074 1.127494
H 0.855180 -2.334646 0.487924
H -1.731416 -0.307860 -4.208968
H 0.383604 -3.390929 2.947457
H 0.950044 -1.808205 3.529230
H -0.461892 -1.906928 2.451744
H 5.109846 -1.036064 -0.698694
H 3.325798 2.849117 0.270886
H 0.671664 -2.792933 -2.880359
H 0.290048 -1.835116 -4.218002
H 2.956134 2.281274 -2.398751


%chk=000193002-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193002

0 1
P 0.911135 3.055407 0.120182
P 1.977050 0.635087 -1.596237
O -2.129356 2.116843 0.186326
O -3.992250 1.803259 3.154948
O -5.198672 1.430376 0.861729
O 0.289873 2.884876 1.688003
O 1.930201 -0.872063 1.594119
O 2.792281 -0.547400 -0.676454
O 0.901009 1.373400 -0.505897
O 5.423605 -0.819144 0.252270
O -1.625176 -0.933498 0.933959
O 2.562405 3.234930 0.552785
O 2.558630 -4.491416 1.723538
O 0.324767 4.117325 -0.886051
O 3.142622 1.941739 -1.758823
O 1.452857 0.101665 -2.986046
N -2.402728 0.036522 -1.046452
N -0.907845 -1.874922 -1.083848
N -0.237151 -2.807764 -3.103313
C -3.118344 1.106637 2.186744
C -3.944776 0.684943 0.918210
C -2.075486 2.125896 1.669431
C -3.089747 1.121320 -0.297769
C -0.647594 1.804794 2.106443
C -2.412367 0.063466 -2.429941
C 4.291451 -1.327671 1.019752
C -1.621020 -0.956838 -0.338337
C 3.040963 -0.444416 0.839625
C 3.951395 -2.792767 0.675219
C 1.495310 -2.314101 1.479747
C 2.675375 -3.295251 1.351452
C -1.721496 -0.867800 -3.172064
C 0.612891 -2.585901 2.698237
C -0.952408 -1.847983 -2.438997
H -2.648030 0.219372 2.635026
H -4.157925 -0.397256 0.909775
H -2.357877 3.142028 1.999946
H -3.753961 1.625819 -1.020294
H -0.561489 1.829806 3.205965
H -0.306711 0.833800 1.711555
H -4.275716 1.176117 3.865184
H -5.271092 1.919883 1.732400
H -2.992014 0.864673 -2.896779
H 4.607837 -1.238610 2.073071
H 3.217643 0.613483 1.098351
H 3.777360 -2.857023 -0.419125
H 4.787066 -3.465500 0.927300
H 0.880932 -2.382420 0.553307
H -1.730081 -0.832206 -4.262012
H 0.333490 -3.652492 2.706870
H 1.153332 -2.356724 3.632913
H -0.299385 -1.975962 2.620792
H 5.141589 -0.775422 -0.698966
H 3.150745 3.178645 -0.257756
H 0.321508 -3.457581 -2.552167
H -0.102742 -2.761721 -4.109960
H 3.466413 2.081042 -2.684186


