%chk=000219232.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219232

0 1
P 0.284941 -0.419145 0.652458
O 1.603196 -0.157345 -0.334016
O -3.177937 2.314722 -0.356967
O 0.002363 -4.787621 -0.481813
O 0.585219 -0.140501 2.084561
N -0.977307 0.536804 -0.104691
N -0.153753 -2.070097 0.293442
C -2.356873 0.093654 0.276019
C -0.801131 2.000903 0.151881
C -0.069137 -2.429690 -1.156184
C 0.575925 -3.055431 1.151447
C -3.359368 0.899645 -0.569971
C -1.845730 2.756886 -0.688232
C -0.673565 -3.835020 -1.328124
C -0.062748 -4.435516 0.916303
C 2.684312 0.629084 0.230452
C 2.707121 1.963455 -0.515145
C 3.820656 2.874516 0.011572
C 3.859617 4.204332 -0.736780
H -2.585355 0.248922 1.356675
H -2.480395 -0.993507 0.061582
H 0.228396 2.318842 -0.165747
H -0.921626 2.278089 1.226091
H 0.976919 -2.425771 -1.544281
H -0.647119 -1.692961 -1.761071
H 0.473225 -2.765976 2.225286
H 1.665424 -3.114793 0.923851
H -4.402396 0.743325 -0.243614
H -3.254028 0.682121 -1.647092
H -1.679044 2.615608 -1.770617
H -1.884626 3.831640 -0.438880
H -1.751910 -3.848931 -1.092946
H -0.493503 -4.246402 -2.336824
H 0.511913 -5.249324 1.392066
H -1.115681 -4.462349 1.246555
H 3.579167 0.014556 0.009487
H 2.588725 0.753006 1.329324
H 1.716572 2.467614 -0.422972
H 2.831602 1.778310 -1.600818
H 4.800950 2.365766 -0.082151
H 3.677368 3.059974 1.095286
H 4.032314 4.060498 -1.809822
H 2.921266 4.759771 -0.627305
H 4.664540 4.846236 -0.359677


%chk=000219232-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219232

0 1
P 0.365239 -0.097723 0.398378
O 1.304878 0.597809 -0.907424
O -3.759281 1.528738 -0.869461
O -0.421853 -4.590305 -0.127012
O 1.003775 0.161542 1.844770
N -1.179080 0.546412 -0.081382
N 0.153449 -1.800725 0.130391
C -2.401681 0.074154 0.618698
C -1.317047 1.931155 -0.600555
C -0.261222 -2.342957 -1.183208
C 0.859368 -2.778854 0.991120
C -3.590212 0.160641 -0.356017
C -2.528389 1.973391 -1.548321
C -1.128205 -3.595206 -0.950319
C -0.046546 -4.008120 1.175805
C 2.741896 0.887249 -0.637288
C 2.940679 2.330320 -0.157705
C 4.439138 2.681731 0.003956
C 4.654269 4.136031 0.475659
H -2.609010 0.703153 1.510693
H -2.254160 -0.969522 0.949824
H -0.398069 2.205274 -1.143074
H -1.475187 2.647935 0.233919
H 0.629965 -2.615223 -1.787733
H -0.834034 -1.573259 -1.730659
H 1.086929 -2.300609 1.960142
H 1.813643 -3.097594 0.518514
H -4.538131 -0.081427 0.152992
H -3.428986 -0.542525 -1.203035
H -2.330712 1.325518 -2.429497
H -2.735466 3.004048 -1.881031
H -2.079503 -3.303351 -0.452140
H -1.350711 -4.107195 -1.901372
H 0.478920 -4.814110 1.714043
H -0.962558 -3.717814 1.734938
H 3.238261 0.708654 -1.607960
H 3.137007 0.174429 0.113272
H 2.418838 2.459318 0.810019
H 2.473524 3.021654 -0.887032
H 4.964056 2.524966 -0.960906
H 4.903372 1.986191 0.732168
H 4.223818 4.855180 -0.246452
H 4.168257 4.309988 1.453652
H 5.729259 4.368935 0.585228


