%chk=000213818.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213818

0 1
Cl 3.808416 -0.447056 -2.708666
O -0.126439 0.598084 2.132741
N -0.516886 1.461832 -0.084507
N -2.644200 2.297878 -0.590139
C -0.024415 0.311800 0.731845
C -1.022939 -0.787663 0.328235
C -1.926278 1.228463 -0.436102
C -0.418549 2.905204 0.279620
C -2.135999 -0.225221 -0.367927
C 1.431172 -0.003883 0.464859
C -1.784897 3.471643 -0.236672
C -0.952792 -2.146667 0.556965
C -3.170223 -1.018551 -0.828379
C 1.890354 -0.056529 -0.858941
C 2.306241 -0.262436 1.528960
C -2.009346 -2.957883 0.089518
C -3.093545 -2.406387 -0.588263
C 3.229988 -0.375732 -1.083145
C 3.644649 -0.577935 1.274634
C 4.119832 -0.639667 -0.038609
H 0.444124 3.344410 -0.258821
H -0.268409 3.065490 1.363817
H -2.309342 4.077923 0.526517
H -1.649099 4.107962 -1.134097
H -0.105668 -2.587919 1.081407
H -4.017455 -0.585313 -1.360323
H -1.060411 0.623929 2.430858
H 1.214695 0.158058 -1.691122
H 1.936158 -0.205962 2.556565
H -1.967155 -4.033472 0.263327
H -3.898437 -3.050621 -0.943571
H 4.322230 -0.775533 2.104940
H 5.160823 -0.885848 -0.245124


%chk=000213818-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213818

0 1
Cl 3.796019 0.277526 -2.782059
O -0.120886 0.460631 2.358574
N -0.618164 1.445865 0.161696
N -2.545515 2.250787 -0.858826
C -0.064340 0.298470 0.879356
C -1.048304 -0.806053 0.418566
C -1.888441 1.205763 -0.411041
C -0.408078 2.900281 0.283914
C -2.136203 -0.241893 -0.307047
C 1.408492 0.026165 0.554332
C -1.635471 3.430108 -0.571753
C -0.996338 -2.184695 0.678728
C -3.191649 -1.043349 -0.778873
C 1.868148 0.261611 -0.764550
C 2.293583 -0.497462 1.525647
C -2.056449 -2.997212 0.202977
C -3.141458 -2.433242 -0.515982
C 3.204915 -0.032440 -1.080420
C 3.634452 -0.780584 1.180349
C 4.107244 -0.552128 -0.132184
H 0.563654 3.213429 -0.135914
H -0.455074 3.224542 1.341619
H -2.206757 4.211078 -0.041191
H -1.300115 3.854394 -1.536323
H -0.156907 -2.621857 1.229397
H -4.020570 -0.596414 -1.336030
H -1.075556 0.441100 2.629005
H 1.186231 0.667879 -1.517730
H 1.928286 -0.653882 2.543348
H -2.036966 -4.076454 0.390178
H -3.946737 -3.083638 -0.874242
H 4.321545 -1.178478 1.934794
H 5.143604 -0.767454 -0.407911


