%chk=000219172.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219172

0 1
Cl 8.034069 -2.238305 0.085556
N -7.138672 -0.072655 -0.226574
N 1.643140 0.066604 -0.080177
N 5.358220 2.094685 -0.047583
C -3.331189 -0.540201 -0.088244
C -4.684619 0.178357 -0.128927
C -2.170501 0.463415 -0.122568
C -5.849667 -0.827981 -0.099171
C -0.813703 -0.252488 -0.085895
C 0.334052 0.766067 -0.119607
C -8.207331 -0.894962 -0.864301
C -7.560565 0.516570 1.086727
C -8.625063 -2.166447 -0.119238
C -8.585659 1.629185 0.861304
C 2.850639 0.739867 -0.071592
C 4.086097 -0.025245 -0.033381
C 2.927719 2.136585 -0.096959
C 5.310672 0.707724 -0.022790
C 4.138764 -1.449684 -0.006191
C 4.197204 2.759402 -0.083323
C 6.560363 0.003259 0.014951
C 5.338205 -2.118747 0.029844
C 6.544028 -1.365106 0.039876
H -3.262754 -1.166173 0.822464
H -3.250256 -1.239140 -0.943564
H -4.767398 0.803680 -1.040921
H -4.772474 0.885789 0.718355
H -2.245381 1.089684 -1.033755
H -2.254707 1.162600 0.732689
H -5.800217 -1.451292 0.818192
H -5.752782 -1.526868 -0.958331
H -0.735837 -0.949425 -0.944316
H -0.745853 -0.878901 0.826061
H 0.260537 1.462868 0.748748
H 0.274419 1.389053 -1.043356
H -7.855327 -1.155176 -1.887836
H -9.093283 -0.235045 -1.004427
H -6.658410 0.947673 1.577153
H -7.970719 -0.243327 1.786843
H 1.628488 -0.947137 -0.067507
H -9.435023 -2.680903 -0.647803
H -8.986700 -1.942780 0.890819
H -7.797241 -2.875869 -0.021978
H -8.751304 2.202131 1.779046
H -9.553464 1.234677 0.532947
H -8.242095 2.327031 0.085508
H 2.041670 2.757546 -0.127270
H 3.207328 -2.017536 -0.014235
H 4.265877 3.855909 -0.102733
H 7.486094 0.583756 0.022497
H 5.385213 -3.206223 0.050675


%chk=000219172-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219172

0 1
Cl 8.193229 -2.355095 0.114569
N -7.211873 -0.075020 -0.209793
N 1.688170 0.097421 -0.056755
N 5.493088 2.071912 -0.121652
C -3.335031 -0.460275 -0.092947
C -4.705482 0.251328 -0.151939
C -2.144591 0.524117 -0.123445
C -5.888362 -0.743165 -0.129730
C -0.773657 -0.185391 -0.069539
C 0.402911 0.808280 -0.103971
C -8.250057 -0.888381 -0.893630
C -7.632919 0.519933 1.083981
C -8.723787 -2.174915 -0.159682
C -8.844354 1.462953 0.961870
C 2.918200 0.726174 -0.076121
C 4.154071 -0.044577 -0.027828
C 3.032904 2.134576 -0.143278
C 5.406079 0.684880 -0.054543
C 4.194534 -1.472296 0.044311
C 4.319155 2.738036 -0.162445
C 6.641319 -0.041124 -0.010237
C 5.406245 -2.169782 0.087379
C 6.620539 -1.429169 0.058405
H -3.277349 -1.077474 0.828322
H -3.249139 -1.165363 -0.946511
H -4.782612 0.860331 -1.073378
H -4.784013 0.956771 0.699558
H -2.205086 1.141073 -1.043502
H -2.229729 1.226824 0.731096
H -5.798666 -1.395318 0.777525
H -5.793738 -1.414037 -1.006606
H -0.689368 -0.884773 -0.926972
H -0.712744 -0.795980 0.854980
H 0.325636 1.507429 0.755773
H 0.343524 1.423239 -1.027231
H -7.845399 -1.166435 -1.886018
H -9.124020 -0.240277 -1.089431
H -6.776561 1.102848 1.470754
H -7.849650 -0.264302 1.854999
H 1.650914 -0.919654 -0.016999
H -9.472436 -2.709194 -0.774079
H -9.193636 -1.940298 0.813037
H -7.881765 -2.866973 0.025457
H -9.027654 1.970864 1.926604
H -9.769708 0.923221 0.691474
H -8.654620 2.231380 0.191438
H 2.147416 2.773110 -0.181917
H 3.272092 -2.065200 0.069105
H 4.393897 3.831509 -0.214793
H 7.570089 0.534228 -0.032389
H 5.428597 -3.261468 0.142427


