%chk=000185393.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185393

0 1
Cl -5.910896 -4.454204 -0.379202
O 5.241204 -0.597290 0.380562
O 8.646060 -0.438200 -0.201967
N -1.197307 0.333820 -0.062071
N 1.711062 0.289402 0.024829
C -0.407729 -0.761357 -0.723471
C -0.391410 1.601698 -0.098520
C 0.907653 -0.976996 0.050009
C 0.927313 1.392009 0.672066
C -2.527477 0.520350 -0.752758
C 3.036132 0.101582 0.694581
C -3.361066 -0.749078 -0.645187
C -3.315472 1.653941 -0.110428
C 4.031844 -0.357542 -0.382876
C -4.116084 -1.165106 -1.752575
C -3.406219 -1.489557 0.547059
C -3.955456 2.592374 -0.933081
C -3.431148 1.759943 1.283497
C -4.910469 -2.312677 -1.676302
C -4.193369 -2.639264 0.636305
C -4.705450 3.625864 -0.363780
C -4.179692 2.795499 1.847614
C -4.934523 -3.032188 -0.480566
C -4.818968 3.729806 1.025706
C 6.379471 -0.951249 -0.440595
C 7.540315 -0.980626 0.556304
C 9.832530 -0.193117 0.597634
C 10.838487 0.349956 -0.402120
H -1.002744 -1.699595 -0.695879
H -0.183196 -0.543593 -1.790621
H -0.169897 1.939025 -1.134713
H -0.972975 2.410616 0.395038
H 0.682043 -1.324714 1.082183
H 1.498092 -1.776597 -0.445832
H 1.529451 2.324691 0.620824
H 0.706873 1.194080 1.743743
H -2.371599 0.759530 -1.842755
H 3.025290 -0.628877 1.532080
H 3.398310 1.056808 1.133290
H 4.214155 0.424085 -1.139244
H 3.725998 -1.293732 -0.877454
H -4.093593 -0.593512 -2.679648
H -2.813524 -1.162711 1.405279
H -3.876120 2.520223 -2.015778
H -2.927008 1.032755 1.921728
H -5.500203 -2.637957 -2.532450
H -4.231406 -3.217133 1.559037
H -5.202969 4.350556 -1.006035
H -4.267475 2.873505 2.930006
H -5.404082 4.534047 1.466864
H 6.546550 -0.180465 -1.217237
H 6.192461 -1.928625 -0.912984
H 7.322026 -0.341343 1.432748
H 7.796400 -1.999618 0.887791
H 10.160653 -1.143544 1.052801
H 9.585498 0.537635 1.387512
H 11.022364 -0.373277 -1.208180
H 10.460543 1.262525 -0.883242
H 11.794950 0.583920 0.075559


%chk=000185393-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185393

0 1
Cl -5.732101 -4.834824 -0.560462
O 5.324666 0.083840 0.541852
O 8.821732 -0.616720 -0.326472
N -1.262293 0.394285 -0.033927
N 1.638056 0.622835 0.204021
C -0.340116 -0.545354 -0.733113
C -0.589747 1.714997 0.113137
C 0.975490 -0.694146 0.045725
C 0.723774 1.563436 0.895561
C -2.582660 0.483523 -0.730208
C 2.976321 0.539034 0.833941
C -3.315797 -0.868116 -0.698791
C -3.482103 1.569848 -0.117834
C 4.048154 0.114713 -0.180105
C -4.171133 -1.229948 -1.766846
C -3.206618 -1.741411 0.412191
C -4.008801 2.598226 -0.935033
C -3.824606 1.545791 1.258450
C -4.913203 -2.432046 -1.735661
C -3.935851 -2.949115 0.462110
C -4.865541 3.585041 -0.393913
C -4.672626 2.532883 1.803535
C -4.783319 -3.273494 -0.614831
C -5.200133 3.555340 0.978371
C 6.448665 -0.275533 -0.328165
C 7.701569 -0.252260 0.545745
C 10.107924 -0.614897 0.384688
C 11.189545 -1.019462 -0.615997
H -0.826495 -1.531733 -0.822193
H -0.108819 -0.179859 -1.765026
H -0.361533 2.164008 -0.885810
H -1.258030 2.404474 0.654747
H 0.755732 -1.160619 1.040527
H 1.643823 -1.378305 -0.507555
H 1.216857 2.550554 0.966433
H 0.483703 1.220339 1.934242
H -2.430976 0.757279 -1.807732
H 3.000397 -0.160278 1.704802
H 3.250634 1.539173 1.216203
H 4.085073 0.846460 -1.015065
H 3.832126 -0.889504 -0.607956
H -4.269066 -0.566712 -2.634808
H -2.526836 -1.472561 1.227977
H -3.743839 2.630963 -1.999348
H -3.418151 0.755962 1.899230
H -5.573163 -2.707546 -2.563302
H -3.847398 -3.623205 1.319175
H -5.266290 4.374411 -1.039840
H -4.927978 2.504044 2.868971
H -5.863256 4.318435 1.401111
H 6.551023 0.451702 -1.161737
H 6.304270 -1.287944 -0.762684
H 7.846919 0.761825 0.976870
H 7.597550 -0.976449 1.382344
H 10.066496 -1.329010 1.237930
H 10.306064 0.399457 0.798803
H 10.984355 -2.025971 -1.019625
H 11.219706 -0.308738 -1.459900
H 12.182055 -1.030617 -0.129655


