%chk=000225293.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225293

0 1
P -0.389792 -0.330607 0.526832
O -0.631257 0.553680 -0.859221
O -1.137949 -1.775094 0.198563
O -0.861466 0.308879 1.782709
O 3.572614 -2.521204 -1.806408
C 1.431091 -0.767604 0.325394
C 3.691407 0.489416 0.026148
C 2.196513 0.558169 0.447951
C 1.595798 -1.406656 -1.055906
C 3.822394 -0.188633 -1.360176
C 3.060833 -1.489782 -1.434436
C 1.724348 -1.755325 1.450545
C 4.533878 -0.276373 1.057847
C 4.231245 1.930954 -0.079299
C -1.833124 1.354833 -0.956214
C -2.427189 -1.990539 0.830255
C -1.751910 2.597388 -0.071769
C -3.524306 -1.659256 -0.181169
C -2.859366 3.595988 -0.429662
C -4.903839 -2.064238 0.350145
C -2.801832 4.834702 0.460976
C -6.008935 -1.739127 -0.651437
H 1.711334 1.336980 -0.183261
H 2.146981 0.938123 1.490639
H 1.144496 -2.424975 -1.088226
H 1.067606 -0.827277 -1.849236
H 3.449269 0.489802 -2.152937
H 4.890585 -0.362867 -1.600556
H 1.575642 -1.326423 2.452085
H 1.124010 -2.674803 1.381955
H 2.780646 -2.080241 1.410587
H 5.593725 -0.292462 0.782673
H 4.207193 -1.324151 1.146860
H 4.460618 0.173300 2.053108
H 3.673372 2.528348 -0.807130
H 5.282506 1.941915 -0.386827
H 4.172807 2.450466 0.883284
H -1.826690 1.610312 -2.035973
H -2.729058 0.729678 -0.738244
H -2.526846 -1.417050 1.774207
H -2.389838 -3.074043 1.061725
H -0.756323 3.070958 -0.180092
H -1.823151 2.319218 1.005276
H -3.308406 -2.174291 -1.139275
H -3.513683 -0.571339 -0.424885
H -2.771883 3.897286 -1.492253
H -3.851007 3.112024 -0.327667
H -4.917138 -3.148629 0.579478
H -5.105876 -1.547347 1.309881
H -3.601616 5.540848 0.211636
H -1.848677 5.365475 0.355357
H -2.912105 4.574018 1.520915
H -5.856589 -2.258191 -1.605072
H -6.990619 -2.041789 -0.268330
H -6.059442 -0.665744 -0.866471


%chk=000225293-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225293

0 1
P -0.551427 -0.549381 0.699982
O -0.955759 0.486435 -0.648874
O -1.200194 -2.117626 0.316857
O -1.070677 0.038053 2.094946
O 3.596712 -2.307210 -1.892573
C 1.316569 -0.861240 0.418463
C 3.492396 0.632544 0.114984
C 2.013459 0.519881 0.611947
C 1.497405 -1.384292 -1.040711
C 3.588699 0.080257 -1.347599
C 2.962678 -1.303666 -1.470967
C 1.724372 -1.934641 1.458730
C 4.509046 -0.116428 1.020266
C 3.869090 2.138812 0.109754
C -1.996606 1.535153 -0.454211
C -2.564081 -2.471850 0.795912
C -1.351935 2.921304 -0.338420
C -3.638313 -2.120161 -0.242138
C -2.416228 4.038780 -0.217261
C -5.040696 -2.604603 0.198120
C -1.785629 5.441580 -0.082223
C -6.133644 -2.264127 -0.838090
H 1.428335 1.276630 0.051257
H 1.966048 0.804129 1.681046
H 1.139554 -2.422525 -1.131615
H 0.907336 -0.748533 -1.731189
H 3.037289 0.769274 -2.020983
H 4.640982 0.038439 -1.679728
H 1.649701 -1.540660 2.487929
H 1.074081 -2.822507 1.376006
H 2.761415 -2.263819 1.286885
H 5.539415 0.191001 0.761343
H 4.460730 -1.211648 0.901604
H 4.341132 0.123677 2.086340
H 3.173562 2.726331 -0.518636
H 4.892596 2.285891 -0.282542
H 3.837903 2.554980 1.134432
H -2.643241 1.463363 -1.347350
H -2.587805 1.310621 0.455350
H -2.753255 -1.967951 1.764527
H -2.513342 -3.562735 0.959799
H -0.716441 3.104348 -1.227179
H -0.692730 2.939130 0.551550
H -3.367861 -2.581015 -1.211436
H -3.658162 -1.023990 -0.401712
H -3.080834 4.015142 -1.104952
H -3.059448 3.837798 0.663203
H -5.016049 -3.701106 0.362117
H -5.300822 -2.147443 1.174344
H -2.561050 6.225428 -0.005264
H -1.150957 5.677939 -0.956970
H -1.150686 5.504051 0.821163
H -5.908499 -2.726110 -1.817620
H -7.125042 -2.627796 -0.511899
H -6.208099 -1.171208 -0.991812


