%chk=000195490.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195490

0 1
P -4.802924 0.685142 -0.224951
O -0.357247 0.679269 2.338202
O -0.968308 2.633568 0.177208
O 1.716540 -0.166029 2.345242
O 0.656957 3.706282 1.283933
O 5.060473 0.654043 -0.209334
O 2.200083 -1.683108 -0.756818
O 4.195778 -0.830407 -1.641081
O -3.594153 -0.389125 -0.066473
O -4.446581 1.764455 0.973097
O -4.316018 1.571325 -1.530808
O -6.173153 0.172723 -0.262448
N 1.695456 0.720926 -1.734369
N -0.971903 -3.376511 0.009184
C 1.049343 1.389368 0.546469
C 0.578846 0.624577 -0.746617
C 2.547008 1.717846 0.334939
C 2.925864 1.235297 -1.075675
C 0.058649 -0.767892 -0.455628
C 0.902024 0.536395 1.806579
C 0.280915 2.700184 0.737927
C 4.060736 0.209033 -1.039181
C -1.306889 -0.975261 -0.163433
C 0.879108 -1.909201 -0.491079
C -2.249061 0.188638 -0.051949
C 0.342924 -3.210076 -0.256430
C -1.774292 -2.283051 0.057214
C 1.210703 -4.422708 -0.293044
H -0.261079 1.211109 -1.238851
H 2.748133 2.803364 0.452642
H 3.181394 1.231243 1.112244
H 3.292934 2.095202 -1.708444
H 1.871776 -0.180041 -2.212308
H -2.105853 0.721887 0.920636
H -2.126267 0.902292 -0.900381
H -2.837871 -2.469553 0.275348
H -0.493795 0.130747 3.162656
H -1.502981 3.468797 0.314365
H 5.833199 0.027998 -0.160829
H 2.729458 -2.511431 -0.909196
H 1.659609 -4.577088 -1.283966
H 2.009928 -4.374374 0.460409
H 0.627356 -5.335780 -0.070534
H -5.200349 2.108670 1.514539
H -4.960372 1.683257 -2.273707


%chk=000195490-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000195490

0 1
P -4.993734 0.832928 -0.501631
O -0.147804 0.357007 2.639911
O -0.583061 2.670917 0.731670
O 1.925933 -0.677159 2.490485
O 1.290921 3.367576 1.890845
O 4.922681 2.330366 -1.651081
O 2.146291 -2.017757 -0.349792
O 4.514958 0.088978 -2.118429
O -3.716561 -0.239921 -0.177484
O -4.427407 2.234853 0.313361
O -4.779020 1.380578 -2.134600
O -6.423613 0.252546 -0.166954
N 1.766535 0.475171 -1.496827
N -1.248866 -3.447786 0.056454
C 1.314039 1.110530 0.875849
C 0.671118 0.462405 -0.509327
C 2.810193 1.286800 0.521530
C 2.769751 1.459158 -1.037419
C 0.001022 -0.899382 -0.336075
C 1.116347 0.172457 2.066984
C 0.707425 2.482076 1.231023
C 4.122456 1.186496 -1.667396
C -1.416708 -1.022542 -0.244482
C 0.747978 -2.102900 -0.236065
C -2.303117 0.203670 -0.348352
C 0.106315 -3.358314 -0.041165
C -1.984154 -2.302830 -0.047840
C 0.911603 -4.636370 0.070554
H -0.093917 1.192618 -0.814007
H 3.260431 2.143130 1.046723
H 3.347977 0.358611 0.779018
H 2.465508 2.491989 -1.289769
H 2.212788 -0.448960 -1.608667
H -2.072449 0.944070 0.435009
H -2.201304 0.691200 -1.338848
H -3.067341 -2.408944 0.030978
H -0.276944 -0.288436 3.386378
H -0.938313 3.545820 1.045840
H 5.820148 2.116698 -2.025824
H 2.582979 -2.872696 -0.113184
H 1.496988 -4.843444 -0.847210
H 1.611092 -4.621309 0.931499
H 0.213276 -5.472667 0.224491
H -4.987490 3.043028 0.198413
H -5.328856 0.891740 -2.799287


