%chk=000203071.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203071

0 1
Cl 4.783347 -3.080093 0.431151
O 1.514496 1.698054 -0.465743
O -0.757401 1.109645 1.009578
N -1.911934 0.498711 -0.893806
C 0.237142 1.678393 -1.146886
C 2.194986 0.503927 -0.289592
C 3.414360 0.671561 0.427385
C -0.829771 1.078437 -0.195846
C -0.050367 3.150591 -1.386294
C 1.773344 -0.740301 -0.759251
C -3.060566 -0.122819 -0.299202
C 4.204911 -0.455613 0.640827
C 3.817317 2.017653 0.921363
C 2.582910 -1.862866 -0.531858
C 3.780411 -1.701775 0.156052
C -4.066132 -0.586277 -1.174223
C -3.197364 -0.281686 1.089758
C -5.198916 -1.205586 -0.645406
C -4.340020 -0.904189 1.595337
C -5.341822 -1.367197 0.736586
H 0.342578 1.103976 -2.093104
H -0.038247 3.713667 -0.437878
H -1.024453 3.311578 -1.860896
H 0.724078 3.603118 -2.022374
H -1.922668 0.540706 -1.914165
H 0.831294 -0.866052 -1.283483
H 5.147041 -0.373586 1.184548
H 4.389887 2.563220 0.156890
H 2.934530 2.635538 1.161039
H 4.433868 1.965223 1.827710
H 2.270390 -2.844196 -0.888312
H -3.970153 -0.468201 -2.249635
H -2.419303 0.076856 1.771865
H -5.977651 -1.565558 -1.317473
H -4.447448 -1.028790 2.673419
H -6.227576 -1.850970 1.141020


%chk=000203071-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203071

0 1
Cl 4.668605 -3.287936 0.425697
O 1.540115 1.792854 -0.438385
O -0.835435 1.362241 1.148458
N -1.837809 0.470831 -0.788069
C 0.206241 1.819099 -1.042111
C 2.193259 0.556711 -0.254510
C 3.485649 0.659422 0.340259
C -0.856448 1.183637 -0.099532
C -0.110380 3.305587 -1.260563
C 1.656592 -0.696736 -0.627547
C -3.011283 -0.160257 -0.273301
C 4.223124 -0.528711 0.537562
C 4.030989 2.010851 0.749806
C 2.407442 -1.877809 -0.422104
C 3.682392 -1.772900 0.154230
C -3.875414 -0.790570 -1.208873
C -3.330078 -0.181829 1.110498
C -5.047564 -1.437080 -0.768668
C -4.509142 -0.833040 1.533656
C -5.372483 -1.461989 0.607884
H 0.235058 1.279038 -2.015689
H -0.114121 3.825523 -0.288400
H -1.099763 3.431754 -1.735047
H 0.656971 3.762619 -1.907479
H -1.719376 0.400829 -1.802730
H 0.655057 -0.785960 -1.056824
H 5.217236 -0.478375 0.992290
H 4.103670 2.690505 -0.118986
H 3.355345 2.501902 1.473346
H 5.030106 1.914022 1.206509
H 1.996680 -2.851906 -0.701547
H -3.630835 -0.774718 -2.279484
H -2.660662 0.300219 1.824785
H -5.705223 -1.919956 -1.499591
H -4.750699 -0.848309 2.602224
H -6.282718 -1.964468 0.951337


