%chk=000295504.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295504

0 1
Cl 4.337043 -2.251316 2.062401
O -1.943969 -1.927149 -1.040498
O -1.328135 0.626292 0.893732
O -3.780695 -0.549011 -0.876933
O -3.727540 2.727354 1.527644
N 0.682510 0.439272 -0.316839
N 2.106307 2.039667 -1.171563
N 2.380602 -0.952698 0.896078
N 4.667657 -0.078830 0.640053
N 5.176967 1.859194 -0.607497
C -1.430909 -0.603456 -1.173183
C -2.669795 0.331557 -1.083662
C -0.560638 -0.256532 0.069612
C -2.414108 1.246477 0.135047
C -3.314153 -1.888527 -0.533919
C -3.590271 1.368882 1.110159
C -3.317343 -2.084957 0.965906
C -4.125418 -2.873283 -1.342318
C 1.970374 0.105063 0.122871
C 0.834285 1.645471 -1.089650
C 2.847566 1.104406 -0.429375
C 4.240746 0.979854 -0.141125
C 3.727722 -0.963652 1.100850
H -0.878440 -0.600570 -2.131987
H -2.922517 0.890764 -2.004368
H -0.317558 -1.141929 0.716541
H -2.051105 2.252070 -0.173531
H -3.457773 0.705067 1.984699
H -4.558846 1.147712 0.613004
H -2.872819 -3.051430 1.240189
H -2.733521 -1.306920 1.481466
H -4.335369 -2.055663 1.373342
H -4.009054 -2.689004 -2.420806
H -3.807015 -3.906823 -1.153124
H -5.195868 -2.792659 -1.111986
H -0.017127 2.138712 -1.535264
H -3.009333 2.968563 2.152356
H 6.153090 1.744752 -0.378067
H 4.898151 2.649881 -1.169355


%chk=000295504-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000295504

0 1
Cl 4.187464 -2.013719 2.454832
O -1.982057 -1.966481 -1.176067
O -1.391090 0.561638 0.911618
O -3.862664 -0.598070 -0.789777
O -3.084637 2.613735 2.049530
N 0.662612 0.465469 -0.394040
N 2.107860 1.985822 -1.339858
N 2.274117 -0.787060 1.020090
N 4.557771 0.073628 0.805632
N 5.131942 1.890805 -0.584559
C -1.483958 -0.596439 -1.216255
C -2.748537 0.320551 -1.070852
C -0.568364 -0.239475 -0.000872
C -2.413360 1.283482 0.088401
C -3.335978 -1.972355 -0.545656
C -3.552390 1.667712 1.034345
C -3.238467 -2.259082 0.958936
C -4.202966 -2.963371 -1.315095
C 1.930707 0.188671 0.132975
C 0.836028 1.558856 -1.269778
C 2.805455 1.132537 -0.464536
C 4.179809 1.047244 -0.089435
C 3.600715 -0.754725 1.284387
H -0.948916 -0.484458 -2.172930
H -3.006896 0.866695 -1.993863
H -0.246568 -1.139578 0.547697
H -1.950351 2.210577 -0.312294
H -3.982440 0.753797 1.486022
H -4.345278 2.195884 0.480388
H -2.784924 -3.252251 1.119761
H -2.626359 -1.498143 1.471048
H -4.248539 -2.257423 1.404627
H -4.218064 -2.697402 -2.383825
H -3.799987 -3.984128 -1.203326
H -5.234324 -2.944375 -0.924571
H 0.011495 2.000288 -1.825271
H -2.342439 2.185467 2.548803
H 6.097547 1.782612 -0.280162
H 4.869734 2.619667 -1.245172


