%chk=000190642.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190642

0 1
P 2.028199 -0.989171 -1.597678
O 0.410354 -0.459108 -1.727803
O 1.855311 -2.366332 -2.448064
O 3.018816 -0.058612 -2.164767
O -2.683813 0.037350 0.689189
O -0.758043 -1.122377 0.826012
N 2.162000 -1.385642 0.068370
C 3.204543 -0.657365 0.854727
C 2.640348 0.651346 1.493021
C 3.762295 -1.639622 1.891904
C 3.793214 1.507075 2.030163
C 1.606951 0.376457 2.587943
C 0.124373 0.827249 -1.367922
C 1.173286 -3.509956 -1.859507
C -0.832625 1.006432 -0.346535
C 0.676111 1.926631 -2.050894
C -0.299021 -3.243605 -1.625200
C -1.276796 2.311247 -0.061754
C -1.354790 -0.140233 0.419499
C -3.384989 -0.996186 1.490794
C 0.238003 3.206638 -1.728000
C -0.742745 3.402024 -0.741056
C -4.838835 -0.762723 1.120108
C -3.064395 -0.745177 2.953767
H 4.047652 -0.364284 0.164429
H 2.134806 1.239817 0.683985
H 1.287587 -1.566295 0.615895
H 4.209307 -2.511702 1.398780
H 4.534457 -1.166344 2.507222
H 2.983226 -2.016253 2.564106
H 4.339512 1.000162 2.832921
H 4.513228 1.752195 1.240551
H 3.422512 2.454236 2.437647
H 2.060509 -0.091707 3.468044
H 1.131308 1.304479 2.921806
H 0.810592 -0.292720 2.232604
H 1.708738 -3.828950 -0.945610
H 1.338426 -4.258333 -2.664215
H 1.440058 1.769474 -2.820032
H -0.496389 -2.717860 -0.675843
H -0.720775 -2.607668 -2.420854
H -0.877348 -4.173424 -1.607178
H -2.045814 2.452124 0.702184
H -3.010758 -1.986532 1.147892
H 0.657442 4.068397 -2.251194
H -1.084687 4.409226 -0.511272
H -4.994082 -0.868838 0.037611
H -5.499842 -1.472136 1.630124
H -5.165817 0.252120 1.383881
H -2.001915 -0.936359 3.162420
H -3.652296 -1.395620 3.611408
H -3.271988 0.292456 3.243071


%chk=000190642-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190642

0 1
P 2.075561 -0.638456 -1.448801
O 0.345854 -0.290372 -1.734450
O 2.210766 -2.073797 -2.392698
O 3.131877 0.442574 -1.933067
O -2.940995 0.048580 0.805593
O -0.828613 -0.914129 0.832623
N 1.980773 -1.002640 0.215459
C 3.144474 -0.905238 1.135947
C 3.360482 0.558796 1.647087
C 2.960827 -1.953335 2.254779
C 4.707957 0.699526 2.394211
C 2.185520 1.077127 2.507441
C -0.208798 0.973775 -1.476139
C 1.498177 -3.323720 -1.995356
C -1.258173 1.096387 -0.517137
C 0.192054 2.087381 -2.250218
C 0.150844 -3.444433 -2.711383
C -1.933734 2.342855 -0.404127
C -1.612822 -0.019127 0.404399
C -3.411825 -0.963389 1.827299
C -0.466467 3.323910 -2.092241
C -1.541528 3.450752 -1.179065
C -4.914735 -1.106256 1.581810
C -3.047578 -0.452936 3.228434
H 4.048219 -1.174254 0.551672
H 3.418636 1.180954 0.730171
H 1.019788 -1.059697 0.601682
H 2.904963 -2.967231 1.821676
H 3.806477 -1.924764 2.963616
H 2.030020 -1.772294 2.822512
H 4.701288 0.156682 3.358371
H 5.547754 0.311772 1.786855
H 4.917541 1.762392 2.614545
H 2.120930 0.541219 3.473478
H 2.319792 2.151210 2.732336
H 1.219092 0.963413 1.981931
H 1.383629 -3.345808 -0.893442
H 2.195579 -4.122860 -2.300237
H 1.009683 1.964093 -2.966670
H -0.528261 -2.631092 -2.406923
H 0.288397 -3.395859 -3.805074
H -0.318107 -4.415593 -2.461356
H -2.756406 2.425137 0.311643
H -2.874452 -1.905654 1.614024
H -0.148212 4.184074 -2.691089
H -2.063383 4.406801 -1.070244
H -5.114384 -1.439427 0.549378
H -5.338226 -1.852208 2.278406
H -5.432154 -0.144553 1.744492
H -1.955161 -0.348511 3.339947
H -3.403127 -1.169791 3.991020
H -3.524411 0.524016 3.423582


