%chk=000206434.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206434

0 1
Cl 4.820798 -4.136124 -0.858318
O -3.313359 0.651129 0.447080
O -6.267936 -0.984361 -0.978980
O -2.930512 2.027316 -1.309688
O -3.998949 -3.011322 -1.020819
N 0.694435 0.729548 1.184374
N -0.625669 0.484750 1.041049
C 1.138869 1.738747 0.298803
C -0.025336 2.157566 -0.423135
C 1.518244 -0.085553 2.103744
C -1.100836 1.337070 0.088397
C 2.349585 -1.093185 1.346753
C 2.403550 2.318228 0.067607
C 0.075857 3.175271 -1.392316
C -2.490606 1.406279 -0.369103
C 2.468639 3.314127 -0.888022
C 1.317275 3.739927 -1.610941
C -4.874164 -0.749713 -0.760962
C -4.709265 0.538935 0.064196
C 3.749044 -1.037585 1.412525
C 1.717595 -2.093428 0.590943
C -4.213805 -1.959179 -0.078224
C 4.521584 -1.982122 0.731097
C 2.479291 -3.039289 -0.097686
C 3.872796 -2.969074 -0.014697
H 0.844867 -0.614305 2.828367
H 2.152804 0.604732 2.709453
H 3.279079 1.981771 0.613618
H -0.816944 3.483363 -1.941263
H 3.422912 3.794169 -1.108223
H 1.435350 4.528762 -2.353716
H -4.487355 -0.621278 -1.803007
H -5.224307 0.501973 1.039368
H -5.035077 1.431653 -0.504354
H 4.244860 -0.262132 1.995392
H 0.626306 -2.129380 0.534724
H -4.811527 -2.342438 0.766161
H -3.188211 -1.714279 0.275296
H 5.610108 -1.948483 0.778595
H 1.995604 -3.817283 -0.690436
H -6.737823 -1.166621 -0.140160
H -4.842370 -3.231285 -1.476993


%chk=000206434-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206434

0 1
Cl 5.416785 -4.094187 -0.653885
O -3.300859 0.488677 0.561192
O -6.490640 -0.724494 -1.064168
O -2.995733 2.107804 -1.105043
O -4.905616 -3.115911 -1.214480
N 0.771355 0.695644 1.123162
N -0.592751 0.447345 1.086552
C 1.156243 1.686900 0.214166
C -0.045295 2.108588 -0.445828
C 1.613422 -0.068964 2.053339
C -1.093579 1.300921 0.138822
C 2.559510 -1.045921 1.359823
C 2.422116 2.245235 -0.081341
C 0.010073 3.125911 -1.434163
C -2.518965 1.358669 -0.213599
C 2.453058 3.252638 -1.062549
C 1.264784 3.687972 -1.729320
C -5.041344 -0.700183 -0.740598
C -4.750138 0.451833 0.237086
C 3.928634 -1.089647 1.714443
C 2.072431 -1.947312 0.379895
C -4.614112 -2.082668 -0.221941
C 4.807319 -2.017555 1.109623
C 2.935587 -2.876215 -0.239245
C 4.293209 -2.896809 0.138780
H 0.905440 -0.606030 2.708157
H 2.188027 0.636010 2.682600
H 3.336401 1.904939 0.413651
H -0.903942 3.447666 -1.940017
H 3.411248 3.712954 -1.327454
H 1.341369 4.474263 -2.487900
H -4.565862 -0.502712 -1.715496
H -5.245597 0.288713 1.211776
H -5.064743 1.411660 -0.206726
H 4.322249 -0.399764 2.470958
H 1.014258 -1.923608 0.095519
H -5.132977 -2.293471 0.743288
H -3.527187 -2.115194 -0.046000
H 5.865252 -2.051628 1.384636
H 2.560840 -3.570632 -0.996624
H -7.006913 -0.835405 -0.222203
H -5.807957 -2.919136 -1.582386


