%chk=000218670.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218670

0 1
Cl -3.426646 -2.305916 2.980162
O 2.422288 -2.623342 -1.688708
N 1.597309 -0.540770 -1.267136
N 3.449719 1.949593 1.185591
N 0.620115 0.385935 -1.064522
C 2.984590 0.028816 -1.139279
C 3.612832 -0.321313 0.215748
C 3.040046 0.517352 1.370503
C 0.035659 -2.385449 -1.917736
C -0.824418 -2.362575 -0.694026
C -1.122751 -1.135717 -0.069559
C 1.441200 -1.911768 -1.600507
C -0.565792 0.142283 -0.570904
C -1.331487 -3.562842 -0.168121
C -1.448009 1.342333 -0.476642
C -1.937398 -1.121875 1.076541
C 4.753281 2.226438 1.858291
C 2.395002 2.876543 1.690533
C -2.139251 -3.553454 0.967703
C -2.429867 -2.325969 1.573271
C -2.762372 1.277231 -0.966445
C -0.968562 2.531683 0.091672
C -3.590862 2.398117 -0.878973
C -1.804271 3.648212 0.176981
C -3.114848 3.582815 -0.306010
H 2.940098 1.138061 -1.269391
H 3.596049 -0.392506 -1.968838
H 4.708407 -0.165462 0.140892
H 3.476927 -1.400173 0.433765
H 3.372832 0.092082 2.340889
H 1.931313 0.436707 1.364890
H 0.107993 -3.408393 -2.354074
H -0.411798 -1.762675 -2.725851
H -1.088347 -4.511660 -0.648726
H -2.178151 -0.177332 1.571042
H 5.073108 3.250271 1.605977
H 5.517934 1.541742 1.458199
H 4.741131 2.128741 2.953507
H 1.468250 2.713735 1.099445
H 2.711718 3.915542 1.507392
H 2.152627 2.772079 2.757300
H -2.535771 -4.482331 1.378842
H -3.133690 0.356176 -1.413747
H 0.067430 2.585325 0.455335
H -4.610119 2.349424 -1.259544
H -1.431552 4.572023 0.616751
H -3.764396 4.453964 -0.239181


%chk=000218670-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000218670

0 1
Cl -3.127395 -2.215226 3.284216
O 2.483892 -2.632749 -1.850956
N 1.646992 -0.549487 -1.233496
N 3.047045 1.747822 1.390176
N 0.656015 0.445318 -1.162109
C 3.031871 -0.003576 -1.142515
C 3.712456 -0.378075 0.190792
C 3.039584 0.263150 1.422682
C 0.042851 -2.292617 -1.985005
C -0.751530 -2.296565 -0.697623
C -1.061755 -1.048558 -0.082380
C 1.485451 -1.874329 -1.683310
C -0.560358 0.230472 -0.656283
C -1.167444 -3.501642 -0.083382
C -1.422793 1.452945 -0.614290
C -1.801498 -1.031974 1.134779
C 4.388287 2.324501 1.615533
C 2.043898 2.330786 2.305381
C -1.893435 -3.491153 1.125930
C -2.197095 -2.245799 1.714229
C -2.839766 1.351998 -0.674562
C -0.829262 2.744114 -0.541931
C -3.643296 2.513028 -0.659367
C -1.634103 3.900018 -0.523003
C -3.045056 3.791260 -0.581437
H 2.933524 1.090580 -1.221414
H 3.620494 -0.404209 -1.986231
H 4.774451 -0.070652 0.125731
H 3.713199 -1.477859 0.303860
H 3.531614 -0.128429 2.350650
H 1.983359 -0.065232 1.461834
H 0.082707 -3.291858 -2.443418
H -0.395825 -1.582628 -2.713401
H -0.922467 -4.459099 -0.555502
H -2.043347 -0.081930 1.618564
H 4.337914 3.424317 1.524070
H 5.100166 1.957818 0.856389
H 4.805146 2.078536 2.626099
H 1.038752 1.954358 2.044597
H 2.035522 3.430653 2.196244
H 2.234339 2.095412 3.383720
H -2.218126 -4.422980 1.597297
H -3.313350 0.367163 -0.750173
H 0.262605 2.814934 -0.507313
H -4.733539 2.419482 -0.713283
H -1.164167 4.887843 -0.460307
H -3.669026 4.691818 -0.566781


