%chk=000238674.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238674

0 1
P 1.187365 -0.057687 -0.351890
O 2.537049 0.865800 -0.484573
O 1.682886 -1.258612 0.691886
O 0.295785 2.089949 0.549531
O 0.680723 -0.453151 -1.677396
C -0.001026 0.741068 0.895801
C -1.394067 0.294559 0.596622
C -1.952711 -0.758242 1.339320
C -2.144208 0.906442 -0.419157
C 3.110402 1.416306 0.739035
C 2.342578 -2.412231 0.109786
C -3.255348 -1.185429 1.071718
C -3.448471 0.476798 -0.678231
C -4.006650 -0.566404 0.066903
C 4.521669 1.796163 0.329445
C 1.362430 -3.300378 -0.632895
H 0.296231 0.558965 1.952717
H -1.370299 -1.249118 2.117862
H -1.700721 1.700881 -1.022090
H 2.501723 2.302398 1.015996
H 3.101911 0.662533 1.547881
H 3.185460 -2.082792 -0.526408
H 2.741665 -2.905775 1.019998
H -0.422667 2.693982 0.850396
H -3.685873 -2.003975 1.646283
H -4.026050 0.950545 -1.470980
H -5.021430 -0.901457 -0.139418
H 5.022821 2.387481 1.102196
H 5.132830 0.909947 0.117899
H 4.504903 2.388544 -0.598695
H 1.809636 -4.268975 -0.880634
H 0.459186 -3.489583 -0.038311
H 1.021667 -2.847251 -1.581299


%chk=000238674-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000238674

0 1
P 1.319499 0.071089 -0.458326
O 2.768593 1.021125 -0.332618
O 1.662523 -1.412431 0.388623
O 0.113090 2.280326 0.700216
O 0.908261 -0.068940 -1.992909
C 0.047648 0.820067 0.783684
C -1.345297 0.252990 0.607868
C -2.060660 -0.200923 1.744041
C -1.976605 0.239717 -0.665641
C 3.300846 1.390852 1.011824
C 2.197573 -2.576682 -0.380263
C -3.391811 -0.654332 1.617367
C -3.309750 -0.208494 -0.787817
C -4.020862 -0.653951 0.350846
C 4.630695 2.096075 0.758373
C 1.058824 -3.409517 -0.973913
H 0.449110 0.576145 1.778609
H -1.575659 -0.193682 2.727536
H -1.414538 0.535870 -1.559568
H 2.575052 2.063872 1.507093
H 3.435229 0.472901 1.617617
H 2.885977 -2.217809 -1.169143
H 2.774921 -3.140172 0.372317
H -0.411120 2.588884 -0.083397
H -3.936166 -1.003981 2.501353
H -3.789310 -0.222440 -1.772645
H -5.054356 -1.004026 0.251584
H 5.079461 2.416544 1.717242
H 5.337577 1.422527 0.244814
H 4.477476 2.987059 0.126580
H 1.467522 -4.321773 -1.448897
H 0.350774 -3.715903 -0.184571
H 0.514880 -2.829686 -1.738581


