%chk=000212938.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212938

1 1
Cl 6.893443 0.183131 0.070969
N 1.021377 -0.645945 0.187148
N -5.471762 -0.138930 0.026767
C 0.164828 0.324817 -0.265623
C 2.431022 -0.454298 0.175903
C -1.277454 0.166107 -0.176920
C 2.958614 0.735453 -0.394159
C 0.712195 1.516493 -0.846287
C 2.059540 1.722120 -0.919691
C 0.491467 -1.936331 0.697551
C 3.319914 -1.428790 0.721950
C -2.072462 0.299080 -1.343071
C -1.929775 -0.042591 1.062566
C -4.109885 -0.030148 -0.038220
C 4.368672 0.929412 -0.425862
C -3.443383 0.191938 -1.289747
C -3.300460 -0.138541 1.142679
C 4.679620 -1.221945 0.684235
C 5.201346 -0.033318 0.101842
C -6.320780 -0.011885 -1.178801
C -6.175788 -0.346689 1.311777
H -0.000540 2.268552 -1.210486
H 2.473493 2.636010 -1.363899
H 0.479320 -1.956203 1.803533
H -0.544914 -2.122600 0.341233
H 1.096882 -2.789553 0.333116
H 2.930584 -2.342742 1.177328
H -1.582555 0.473961 -2.305086
H -1.334032 -0.105372 1.976472
H 4.776301 1.844438 -0.868853
H -4.021463 0.283446 -2.207399
H -3.769894 -0.282540 2.113676
H 5.373430 -1.962970 1.100482
H -7.388175 -0.153790 -0.932164
H -6.056708 -0.775814 -1.933764
H -6.220253 0.990730 -1.635153
H -7.268452 -0.411903 1.162108
H -5.991233 0.491482 2.009603
H -5.855778 -1.289576 1.792746


%chk=000212938-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212938

1 1
Cl 7.007370 0.380467 0.267081
N 1.051682 -0.693270 0.194151
N -5.545299 -0.074082 0.067254
C 0.161353 0.197679 -0.401893
C 2.446012 -0.444011 0.232549
C -1.287964 0.062047 -0.270635
C 2.981812 0.686770 -0.481151
C 0.709332 1.299345 -1.141081
C 2.072941 1.537897 -1.194641
C 0.585382 -2.017679 0.697188
C 3.333327 -1.293819 0.951867
C -2.138396 0.413769 -1.368316
C -1.929993 -0.314280 0.953886
C -4.171299 -0.027516 -0.041430
C 4.385751 0.935208 -0.466225
C -3.528349 0.356291 -1.271677
C -3.319320 -0.348409 1.074945
C 4.711316 -1.033792 0.958258
C 5.228861 0.078489 0.242937
C -6.400580 0.277485 -1.085397
C -6.183409 -0.453558 1.344719
H 0.007573 1.988973 -1.613880
H 2.463073 2.396554 -1.750345
H 0.581925 -2.055195 1.799559
H -0.430341 -2.205984 0.327956
H 1.253775 -2.801617 0.306608
H 2.966865 -2.145646 1.527608
H -1.694910 0.689633 -2.331484
H -1.329282 -0.517267 1.846825
H 4.787911 1.795006 -1.010286
H -4.125595 0.606422 -2.151245
H -3.754042 -0.601459 2.044601
H 5.388813 -1.683283 1.519597
H -7.456907 0.161425 -0.803893
H -6.204422 -0.385308 -1.949059
H -6.243963 1.326429 -1.400747
H -7.275951 -0.444621 1.223225
H -5.924618 0.256863 2.152764
H -5.884133 -1.471258 1.658304


