%chk=000228542.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228542

0 1
Cl -1.213582 0.069791 2.930010
O -5.679289 -0.139083 -1.947404
N 1.807382 0.025059 0.037320
C -0.906155 0.029369 1.111265
C -0.150438 1.291864 0.807409
C -0.119366 -1.231873 0.889124
C 1.165700 1.267104 0.294271
C 1.197903 -1.211340 0.380586
C -2.237074 -0.001624 0.385961
C -0.760997 2.533521 1.053387
C -0.705027 -2.466779 1.218306
C 3.176063 0.025069 -0.460251
C 1.837270 2.481055 0.015708
C 1.898056 -2.426213 0.188824
C -2.217610 -0.371100 -0.978361
C -3.452224 0.344434 0.981477
C -0.098064 3.726808 0.781856
C -0.013948 -3.660071 1.031593
C 1.202877 3.693267 0.259582
C 1.289412 -3.632414 0.514102
C 4.247054 0.056427 0.447010
C 3.397838 -0.006623 -1.845677
C -3.384262 -0.405653 -1.726106
C -4.646565 0.316044 0.248742
C -4.600477 -0.060075 -1.096283
C 5.553373 0.055403 -0.047211
C 4.711685 -0.006997 -2.320991
C 5.786797 0.023767 -1.426517
C -6.985958 0.189869 -1.416861
H -1.771686 2.552961 1.468376
H -1.718406 -2.477408 1.628922
H 2.849551 2.473955 -0.384587
H 2.912060 -2.423466 -0.206955
H -1.267686 -0.633928 -1.449927
H -3.507346 0.645929 2.029938
H -0.583251 4.679913 0.975864
H -0.478322 -4.608622 1.288974
H 1.723326 4.627196 0.045373
H 1.832034 -4.566936 0.367891
H 4.057059 0.081126 1.520397
H 2.555605 -0.029928 -2.536731
H -3.385859 -0.689439 -2.775778
H -5.578591 0.583698 0.733862
H 6.393278 0.079537 0.647070
H 4.897011 -0.031401 -3.394725
H 6.808199 0.023200 -1.804511
H -7.628390 0.039064 -2.294311
H -7.010710 1.232448 -1.087446
H -7.253949 -0.500102 -0.611666


%chk=000228542-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228542

0 1
Cl -0.665044 0.310080 2.603375
O -6.387619 -0.025555 -1.135923
N 1.990637 0.038047 -0.063163
C -0.845219 0.123878 0.470898
C -0.103591 1.330519 0.005827
C -0.138000 -1.165254 0.219873
C 1.314158 1.273085 -0.183876
C 1.280545 -1.180570 0.027101
C -2.340869 0.111068 0.159686
C -0.762149 2.578849 -0.155712
C -0.833766 -2.402873 0.256909
C 3.443668 0.013491 -0.112835
C 2.031455 2.461461 -0.502912
C 1.963431 -2.425293 -0.084912
C -2.707891 0.120089 -1.218682
C -3.372004 0.050571 1.119614
C -0.055657 3.745823 -0.486281
C -0.161220 -3.628297 0.127930
C 1.351961 3.681099 -0.650558
C 1.248316 -3.632508 -0.032204
C 4.173940 0.103760 1.093593
C 4.114000 -0.098391 -1.352582
C -4.053279 0.073490 -1.615546
C -4.733896 0.004952 0.737081
C -5.077186 0.015769 -0.635375
C 5.586768 0.082109 1.057684
C 5.526799 -0.119208 -1.383567
C 6.264403 -0.028858 -0.179360
C -7.479374 -0.082307 -0.160859
H -1.843716 2.618057 0.005379
H -1.917258 -2.383554 0.407993
H 3.115574 2.424125 -0.635366
H 3.048253 -2.440872 -0.216017
H -1.925891 0.163625 -1.985211
H -3.101043 0.046987 2.178661
H -0.583424 4.698038 -0.599561
H -0.717125 -4.570512 0.164851
H 1.919457 4.585597 -0.896463
H 1.789221 -4.581264 -0.121142
H 3.631851 0.189524 2.040923
H 3.529868 -0.167981 -2.276465
H -4.335858 0.081112 -2.672611
H -5.503175 -0.036486 1.514103
H 6.154902 0.152185 1.991467
H 6.048620 -0.205870 -2.342738
H 7.359465 -0.044935 -0.205025
H -8.400264 -0.105205 -0.761789
H -7.481854 0.811399 0.493143
H -7.416620 -0.996195 0.461545


