%chk=000246506.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246506

0 1
Cl -9.550567 3.261248 0.879657
Cl -8.561907 -3.379843 -1.428246
O 9.353519 -0.090835 1.788712
O 9.138268 1.533903 -1.873590
O 1.054485 -2.282132 -0.095405
N 6.970698 0.286210 -0.102732
N -7.226661 0.021885 0.344795
N 0.582086 -0.005399 -0.072821
N -0.767901 -0.212090 -0.008519
C 7.578732 1.185027 0.904969
C 7.939945 -0.319709 -1.046317
C 5.628560 -0.066342 -0.078589
C -8.148381 1.138279 -0.002498
C -7.801602 -1.330408 0.141195
C -5.826457 0.206256 0.167036
C 8.051766 0.416506 2.148799
C 8.141261 0.573003 -2.280262
C 5.088843 -0.935662 -1.069292
C 4.758274 0.450410 0.923444
C -5.282955 1.500374 0.002533
C -4.945941 -0.897724 0.253557
C 2.886004 -0.732006 -0.069496
C -8.467992 1.893911 1.292022
C -7.799537 -1.766383 -1.328443
C 3.742855 -1.264809 -1.048829
C 3.412509 0.114928 0.917605
C -3.028241 0.582292 0.020710
C -3.903321 1.677935 -0.066242
C -3.570569 -0.706653 0.183999
C 1.457053 -1.144598 -0.072176
C -1.576665 0.813982 -0.060704
H 6.864297 1.987517 1.190428
H 8.464067 1.693018 0.430178
H 7.613774 -1.338159 -1.351373
H 8.926605 -0.441398 -0.518103
H -9.088278 0.756286 -0.461311
H -7.706002 1.829828 -0.757794
H -8.838311 -1.342682 0.551503
H -7.226342 -2.062315 0.760462
H 7.387396 -0.427027 2.406902
H 8.166081 1.087269 3.019158
H 7.220237 1.105724 -2.575699
H 8.536362 -0.003728 -3.135566
H 5.729838 -1.354357 -1.839950
H 5.141823 1.103830 1.700707
H -5.928665 2.372624 -0.068035
H -5.331140 -1.906468 0.393219
H -8.985863 1.254696 2.030972
H -7.559911 2.304931 1.773218
H -6.772862 -1.845667 -1.737630
H -8.372330 -1.078597 -1.976299
H 3.336507 -1.947572 -1.800381
H 2.758680 0.505410 1.700611
H -3.505472 2.685361 -0.191057
H -2.897712 -1.568683 0.254961
H -1.274769 1.865989 -0.162629
H 9.687705 -0.686674 2.486180
H 9.285849 2.187224 -2.583345
H 0.978376 0.937361 -0.162100


%chk=000246506-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246506

0 1
Cl -9.448138 2.973231 2.139397
Cl -8.929427 -3.241104 -1.788501
O 8.958337 0.211110 2.327444
O 9.104569 1.180935 -2.084480
O 1.183212 -2.179253 -1.029870
N 7.136009 0.272910 -0.035956
N -7.288254 0.065727 0.110283
N 0.598387 -0.037883 -0.260502
N -0.756713 -0.295825 -0.273208
C 7.607076 1.429224 0.746837
C 8.172392 -0.548652 -0.687585
C 5.778944 -0.028528 -0.155445
C -8.180497 1.210952 0.358596
C -7.923342 -1.249024 -0.087953
C -5.884401 0.223190 0.070879
C 7.807048 1.126688 2.240405
C 8.460051 -0.143664 -2.141496
C 5.315719 -1.102292 -0.990719
C 4.777884 0.711845 0.559031
C -5.271627 1.489586 0.319875
C -5.021028 -0.883334 -0.219003
C 2.962706 -0.646317 -0.414636
C -8.323502 1.476088 1.869684
C -8.110152 -1.548622 -1.587743
C 3.951875 -1.399704 -1.101830
C 3.413309 0.409393 0.424390
C -3.019119 0.533584 0.001410
C -3.873731 1.633152 0.280715
C -3.628746 -0.729615 -0.248456
C 1.533830 -1.046608 -0.593276
C -1.567885 0.714313 -0.022643
H 6.906669 2.277131 0.632958
H 8.569794 1.757232 0.320502
H 7.890018 -1.616736 -0.651976
H 9.100626 -0.448168 -0.101155
H -9.176827 0.994361 -0.065558
H -7.811494 2.118398 -0.151197
H -8.911067 -1.252103 0.406160
H -7.331188 -2.050919 0.386461
H 6.895800 0.661434 2.669115
H 8.018915 2.075833 2.779429
H 7.519637 -0.103014 -2.728442
H 9.141980 -0.892870 -2.599333
H 6.026761 -1.704520 -1.562459
H 5.066007 1.513464 1.244125
H -5.877687 2.370791 0.549728
H -5.435894 -1.873996 -0.427360
H -8.806212 0.639273 2.395911
H -7.365058 1.728489 2.345006
H -7.154626 -1.609138 -2.127699
H -8.783864 -0.828272 -2.075344
H 3.614724 -2.230414 -1.731195
H 2.703538 0.982480 1.035148
H -3.437330 2.621013 0.477016
H -2.981306 -1.584163 -0.470659
H -1.191099 1.739416 0.182522
H 9.052010 -0.125415 3.252813
H 9.215233 1.539813 -2.999582
H 0.943257 0.914398 -0.068476


