%chk=000259108.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259108

0 1
P -3.547260 0.581291 -0.214452
O -2.322037 0.408565 -1.344341
O -1.512803 -2.130108 -1.540504
O -3.213798 -0.540333 0.947763
O -4.779577 -0.102715 -1.027248
O -3.742586 1.961745 0.242932
C 1.102398 0.746404 0.084294
C 1.557969 -0.620128 -0.045207
C -0.209483 1.119256 -0.327565
C 0.706876 -1.618447 -0.592309
C 1.976833 1.731871 0.619604
C 2.872633 -0.976076 0.369827
C -1.074743 0.072948 -0.854379
C -0.633863 -1.219639 -0.999934
C 3.309806 1.334809 1.040638
C 3.734219 0.054021 0.923723
C -0.613609 2.457876 -0.221197
C 1.168620 -2.936503 -0.719440
C 1.538621 3.062652 0.726656
C 3.306678 -2.305210 0.232761
C 0.256724 3.416256 0.305145
C 2.459437 -3.273919 -0.308266
C -2.667554 0.000442 2.174753
C -4.535836 -1.464005 -1.479328
H 3.957233 2.109589 1.453124
H 4.734774 -0.242369 1.238563
H -1.614023 2.764228 -0.551095
H 0.514914 -3.700060 -1.143123
H 2.204062 3.821555 1.136192
H 4.312316 -2.581108 0.549016
H -0.074894 4.452716 0.384576
H 2.808436 -4.301480 -0.411708
H -1.112721 -3.041265 -1.562864
H -1.584655 0.140411 2.054120
H -2.870658 -0.796076 2.904600
H -3.161704 0.933301 2.482475
H -5.395596 -1.647027 -2.138287
H -4.550439 -2.148395 -0.621717
H -3.592712 -1.541973 -2.045300


%chk=000259108-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259108

0 1
P -3.629797 0.609036 -0.167781
O -2.266653 0.361650 -1.255556
O -1.455911 -2.218189 -1.392520
O -3.374503 -0.574028 1.073468
O -4.882761 -0.017454 -1.132469
O -3.892880 2.088221 0.332804
C 1.255459 0.744610 0.044142
C 1.711005 -0.611895 -0.072238
C -0.090534 1.095756 -0.337115
C 0.830943 -1.640446 -0.570903
C 2.145378 1.766897 0.536960
C 3.062279 -0.953840 0.303279
C -0.965308 0.043865 -0.809310
C -0.533592 -1.274191 -0.917734
C 3.492942 1.395521 0.911808
C 3.933446 0.089788 0.800263
C -0.522530 2.444751 -0.222962
C 1.320630 -2.968122 -0.706289
C 1.678635 3.105208 0.639678
C 3.505793 -2.297709 0.171787
C 0.360466 3.433296 0.262033
C 2.642541 -3.290573 -0.331677
C -3.172584 -0.101084 2.467340
C -4.778146 -1.392183 -1.697848
H 4.162816 2.178079 1.286915
H 4.957228 -0.179076 1.085061
H -1.542465 2.716104 -0.509654
H 0.694400 -3.768159 -1.122100
H 2.355790 3.881706 1.013591
H 4.532024 -2.553340 0.458676
H 0.011065 4.467712 0.344528
H 2.999536 -4.319610 -0.443560
H -1.135811 -3.138157 -1.222056
H -2.126666 0.221904 2.608901
H -3.391844 -0.978806 3.093338
H -3.858021 0.730100 2.707169
H -5.542982 -1.416461 -2.487878
H -5.006254 -2.129836 -0.909683
H -3.771140 -1.567947 -2.109911


