%chk=000187420.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187420

0 1
P -3.782614 -0.818716 0.410705
O 2.703570 -1.138945 2.791871
O 3.546248 1.045690 -0.060851
O 2.643843 -3.309296 0.319721
O -0.708935 -1.142172 -1.389399
O -2.004284 0.486152 -2.291050
O -4.602540 0.510866 -0.123650
O -2.485506 -0.190827 1.232979
O -4.592939 -1.780659 1.191248
C 1.643573 -1.032991 0.444990
C 2.541097 -0.417270 1.530826
C 1.237197 0.121967 -0.540375
C 3.830632 -0.090697 0.762823
C 2.670950 -2.009850 -0.256255
C 2.127609 0.210750 2.820199
C 4.068084 -1.366984 -0.064078
C 2.520511 0.847415 -1.082644
C 0.450211 -1.791258 0.998308
C 0.337885 1.152745 0.173013
C 0.517741 -0.458891 -1.781889
C 2.294727 2.239975 -1.585874
C -0.037849 2.340166 -0.719591
C 1.153606 2.925116 -1.421202
C 0.974551 4.311324 -1.952856
C -1.918825 -0.548829 -1.672969
C -2.998897 -1.435557 -1.169491
C -5.734055 0.893636 0.693680
C -2.681544 -0.100439 2.665381
H 4.686499 0.245717 1.373734
H 2.418126 -2.212822 -1.316841
H 1.081569 0.238994 3.115035
H 2.757819 0.956535 3.300214
H 4.741835 -2.067163 0.462948
H 4.563274 -1.142323 -1.021762
H 2.999049 0.226483 -1.877198
H 0.085150 -2.533500 0.272281
H 0.708733 -2.330086 1.919091
H -0.397637 -1.125740 1.218407
H 0.869874 1.540718 1.063883
H -0.584134 0.653104 0.544399
H 0.286482 0.327497 -2.526341
H 1.091151 -1.278825 -2.256306
H 3.167080 2.677433 -2.068341
H -0.796840 2.033779 -1.480305
H -0.549561 3.110064 -0.108011
H 2.744247 -3.259779 1.300050
H 0.929617 5.041991 -1.132388
H 0.042687 4.407373 -2.527565
H 1.794757 4.622712 -2.613154
H -2.619944 -2.473772 -0.992462
H -3.797001 -1.532427 -1.945963
H -6.305174 0.030844 1.066574
H -5.385487 1.534158 1.512616
H -6.347915 1.479589 -0.007510
H -3.181509 0.847879 2.896969
H -3.231207 -0.961343 3.076338
H -1.653585 -0.092511 3.056037


%chk=000187420-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187420

0 1
P -3.929461 -0.582789 0.281973
O 3.101455 -1.092748 2.800219
O 3.321695 1.384171 -0.083749
O 3.154423 -3.157438 0.449774
O -0.912652 -1.126610 -1.129778
O -2.047200 -0.162472 -2.938551
O -3.719915 1.056943 -0.223275
O -2.713032 -0.808874 1.512247
O -5.391056 -0.992153 0.774504
C 1.798747 -1.013521 0.549443
C 2.656376 -0.267150 1.588010
C 1.175214 0.080257 -0.436667
C 3.823170 0.290948 0.780347
C 2.968321 -1.836443 -0.161021
C 2.262587 0.163125 2.949533
C 4.259287 -0.955690 -0.025399
C 2.334281 0.908137 -1.101791
C 0.733461 -1.945677 1.163927
C 0.268309 1.100636 0.313209
C 0.402775 -0.593250 -1.601134
C 1.869544 2.149787 -1.825431
C -0.341421 2.158468 -0.636543
C 0.660061 2.739359 -1.620163
C 0.227519 3.979371 -2.373050
C -2.042739 -0.826166 -1.880280
C -3.269697 -1.455842 -1.240314
C -4.357644 2.131471 0.569364
C -3.148532 -1.264166 2.857501
H 4.618429 0.749496 1.387420
H 2.736379 -2.074455 -1.211725
H 1.237823 -0.019119 3.296729
H 2.786776 1.000802 3.426533
H 5.019672 -1.526338 0.534858
H 4.701430 -0.676037 -0.996984
H 2.878812 0.255119 -1.820250
H 0.473484 -2.752510 0.460605
H 1.124219 -2.417822 2.082352
H -0.195896 -1.407120 1.409338
H 0.898455 1.624179 1.055165
H -0.541879 0.582779 0.854323
H 0.212056 0.118647 -2.422552
H 0.944049 -1.467909 -2.000200
H 2.587598 2.593287 -2.526283
H -1.202961 1.741283 -1.196632
H -0.770310 2.981615 -0.028744
H 3.259365 -3.027782 1.429457
H 0.029794 4.815653 -1.673532
H -0.715886 3.796476 -2.924348
H 0.991109 4.311278 -3.097172
H -3.053968 -2.488934 -0.923386
H -4.096599 -1.443991 -1.966985
H -5.414115 1.886074 0.779052
H -3.806546 2.295203 1.513167
H -4.294332 3.027160 -0.065478
H -2.990925 -0.438801 3.572164
H -4.213849 -1.557764 2.846488
H -2.514062 -2.125152 3.121715


