%chk=000189854.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189854

0 1
P -1.056687 3.050439 -0.087922
O 1.848191 0.644749 1.102202
O 4.741000 1.482366 -0.263493
O 4.596192 -0.798581 0.759576
O 0.552143 3.113045 -0.365042
O 2.239840 -3.051840 -0.844472
O -2.559155 -0.755843 0.316869
O -1.197490 1.796732 0.940889
O -1.654694 2.280808 -1.449414
O -2.273272 -2.973917 -1.585173
O -1.682041 4.337497 0.198728
O -3.962655 1.236573 0.895878
O -5.550253 0.777573 -0.617238
N 1.040776 -1.362814 0.198240
N -0.037725 -3.035596 -1.167614
C 3.522652 0.864199 -0.613533
C 3.478539 -0.613692 -0.112664
C 2.325411 1.569208 0.080452
C 2.244932 -0.693261 0.825092
C 1.196561 1.927463 -0.893900
C -0.217885 -0.809173 0.484838
C 1.162451 -2.533807 -0.614829
C -1.348540 -1.312911 -0.079825
C -1.351407 -2.474331 -0.982252
C -3.353619 -0.289561 -0.817232
C -4.431219 0.581564 -0.223284
H 3.500380 0.945310 -1.721712
H 3.491543 -1.360653 -0.933969
H 2.632555 2.463526 0.677059
H 2.461774 -1.159087 1.818159
H 0.497189 1.088876 -1.063936
H 1.603659 2.274435 -1.869351
H 5.033481 1.189361 0.647863
H 5.286564 -1.344675 0.313682
H -0.237926 0.057806 1.187060
H 0.043696 -3.886502 -1.748276
H -2.721195 0.296656 -1.521142
H -3.785327 -1.181792 -1.326670
H -2.119736 1.353211 1.043212
H -2.067038 2.848591 -2.143683
H -4.640064 1.833544 1.319224


%chk=000189854-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189854

0 1
P -0.984674 3.455217 0.994699
O 1.802053 0.649457 1.077727
O 4.075254 1.398480 -1.702792
O 4.596813 -0.404574 0.161177
O 0.667832 3.437536 0.542803
O 2.327135 -3.372129 -0.109679
O -2.682919 -1.079938 0.384761
O -1.359935 1.826498 1.216509
O -1.881370 3.666772 -0.535131
O -2.286618 -3.715501 -0.871092
O -1.308134 4.548879 2.079965
O -3.135608 1.403974 -0.593904
O -3.753681 0.565922 -2.669569
N 0.984421 -1.478626 0.285830
N 0.014262 -3.476526 -0.506353
C 2.925311 0.774738 -1.088026
C 3.257272 -0.579665 -0.405994
C 2.293118 1.624956 0.056244
C 2.207191 -0.696218 0.729070
C 1.162887 2.491772 -0.488076
C -0.291085 -0.933617 0.427824
C 1.187635 -2.819005 -0.107193
C -1.423471 -1.629674 0.070666
C -1.327961 -2.992581 -0.473194
C -3.648353 -0.958650 -0.726287
C -3.518945 0.377505 -1.462370
H 2.193606 0.609670 -1.899600
H 3.229579 -1.434072 -1.099008
H 3.060573 2.250544 0.544113
H 2.623678 -1.193414 1.622090
H 0.339973 1.863288 -0.878306
H 1.568116 3.116999 -1.304525
H 4.862050 1.148771 -1.142138
H 5.005351 -1.285315 0.344897
H -0.345079 0.062496 0.880681
H 0.136337 -4.443529 -0.826405
H -3.556449 -1.791054 -1.442354
H -4.643555 -1.005438 -0.250713
H -2.197050 1.474813 0.736312
H -2.006945 4.609332 -0.808766
H -2.917015 2.307403 -1.001497


