%chk=000206739.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206739

0 1
P -0.953112 -0.089731 -0.449963
O -1.837634 0.853850 0.598672
O -1.312836 -1.616245 0.085529
O -1.262657 0.025718 -1.892544
C 0.743984 0.285149 0.118843
C 1.843043 -0.217490 -0.587984
C 0.908439 1.101938 1.238764
C 3.136814 0.106567 -0.129013
C 1.696201 -1.085175 -1.792975
C -3.224036 1.093404 0.237502
C -1.085110 -1.886229 1.496530
C 2.194213 1.417920 1.683034
C 3.305644 0.915359 0.993556
C -3.338431 2.088147 -0.901930
C -1.796652 -3.207570 1.729607
H 0.042453 1.507435 1.775221
H 4.008111 -0.273339 -0.658121
H 2.640866 -1.235360 -2.330452
H 1.315265 -2.086128 -1.534114
H 0.986061 -0.663859 -2.533224
H -3.729808 0.134318 0.017318
H -3.616901 1.506202 1.189572
H 0.006673 -1.969462 1.662582
H -1.509955 -1.073616 2.117215
H 2.333733 2.053641 2.553469
H 4.310843 1.161596 1.337260
H -4.368611 2.439109 -1.024044
H -2.701149 2.966285 -0.735927
H -3.025889 1.651443 -1.868062
H -1.625818 -3.587532 2.741628
H -2.878996 -3.109070 1.573214
H -1.451445 -3.966476 1.012340


%chk=000206739-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206739

0 1
P -0.978749 -0.107071 -0.477231
O -1.926061 0.923787 0.558524
O -1.325686 -1.727513 0.089415
O -1.326130 -0.022971 -2.028897
C 0.736089 0.312488 0.089886
C 1.844946 -0.308625 -0.558603
C 0.917335 1.254764 1.129583
C 3.142500 0.054850 -0.117349
C 1.663606 -1.316854 -1.679168
C -3.324863 1.235563 0.134072
C -1.193950 -2.028282 1.542367
C 2.221399 1.595560 1.549145
C 3.334480 0.992785 0.921919
C -3.361914 2.470896 -0.768996
C -1.548564 -3.504408 1.707406
H 0.040297 1.715856 1.592208
H 4.011127 -0.406578 -0.601095
H 2.637528 -1.699996 -2.025854
H 1.048036 -2.175789 -1.351150
H 1.131999 -0.866842 -2.537399
H -3.762424 0.355932 -0.375737
H -3.854298 1.401761 1.087707
H -0.155927 -1.820814 1.872795
H -1.883462 -1.375038 2.111034
H 2.363932 2.324976 2.353342
H 4.350824 1.253290 1.238157
H -4.411488 2.742034 -0.991941
H -2.879499 3.330857 -0.272701
H -2.843311 2.265698 -1.720423
H -1.478817 -3.795092 2.772277
H -2.576505 -3.696258 1.356200
H -0.859144 -4.138168 1.124008


