%chk=000249445.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249445

0 1
Cl -0.098205 -4.672166 0.291527
Cl -5.241807 2.265622 -2.381372
P -1.826679 0.113952 0.515970
O -1.604779 -0.167449 -0.926509
O 4.301914 -0.833587 -1.612349
O 2.473483 -1.958279 -1.333571
N -1.968616 -1.303018 1.530275
N -3.247279 1.047086 0.942675
N -0.577736 1.087634 1.294728
N 3.186587 -0.985666 -1.145527
C -1.717698 -2.601881 0.853785
C -3.788978 1.897323 -0.148872
C 0.773393 1.075963 0.886516
C 1.283687 0.097137 0.010293
C -0.232831 -2.927383 0.648697
C -4.338292 1.118053 -1.350701
C 1.653806 2.045268 1.432991
C 2.653895 0.088626 -0.258822
C 3.010437 2.016534 1.124659
C 3.533390 1.031604 0.276797
H -1.536624 -1.267909 2.470561
H -3.999823 0.533719 1.440728
H -0.864862 1.892199 1.879474
H -2.199829 -3.391965 1.483501
H -2.247674 -2.640464 -0.130768
H -4.596193 2.532087 0.295633
H -3.007060 2.617437 -0.493187
H 0.639274 -0.641772 -0.494238
H 0.215455 -2.375841 -0.211693
H 0.381029 -2.718604 1.543232
H -3.526837 0.670123 -1.971955
H -5.030004 0.308384 -1.058065
H 1.268786 2.817638 2.097214
H 3.678643 2.769356 1.547936
H 4.597527 1.002042 0.031738


%chk=000249445-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249445

0 1
Cl -1.425766 -4.990022 -0.179374
Cl -5.839081 1.864406 -2.225417
P -1.615827 0.191789 0.324588
O -1.521656 -0.157256 -1.233068
O 4.895946 -0.916334 -0.890741
O 2.858943 -1.920035 -1.091701
N -1.414848 -1.150449 1.402918
N -3.109460 0.953253 0.771456
N -0.437906 1.339386 0.956998
N 3.619009 -0.947830 -0.709491
C -1.846599 -2.516401 1.035401
C -3.908046 1.721251 -0.208321
C 0.963010 1.287250 0.789071
C 1.581861 0.218257 0.091478
C -0.826186 -3.223631 0.123839
C -4.770729 0.798477 -1.087786
C 1.777417 2.315450 1.344938
C 2.985806 0.199881 -0.005081
C 3.180336 2.270464 1.212519
C 3.812840 1.205849 0.537083
H -0.722862 -1.052343 2.149451
H -3.585630 0.589778 1.600324
H -0.837715 2.182006 1.376275
H -1.999832 -3.097440 1.962260
H -2.820524 -2.465845 0.516377
H -4.544297 2.440923 0.337358
H -3.228805 2.301723 -0.856713
H 1.002132 -0.567413 -0.399849
H -0.758680 -2.743883 -0.863159
H 0.167801 -3.316842 0.587042
H -4.146363 0.171129 -1.740351
H -5.475117 0.191250 -0.498324
H 1.307489 3.149300 1.880016
H 3.785635 3.073137 1.645833
H 4.897206 1.142569 0.425452


