%chk=000289037.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289037

0 1
Cl 4.753357 1.075307 0.993737
O -2.502711 -3.696112 0.787180
O 1.979042 -3.423757 -0.435412
O 0.565545 -3.188488 1.183624
N -0.687876 -0.881546 -0.210502
N -2.914458 -0.569089 -0.847797
N 1.354652 -2.754500 0.365576
C -0.249903 1.950554 -0.137822
C 0.846745 1.027700 0.129909
C -1.533341 1.437980 -0.444719
C 0.564880 -0.371481 0.094638
C -1.696828 -0.028371 -0.484475
C 1.622062 -1.291976 0.368145
C -0.065342 3.356042 -0.097113
C 2.156222 1.461515 0.416879
C -2.598239 2.332946 -0.702237
C -3.160770 -2.028888 -0.849230
C 2.911748 -0.853170 0.628951
C 3.158219 0.531313 0.655199
C -1.119428 4.214840 -0.351982
C -2.397862 3.701335 -0.657122
C -3.381102 -2.597901 0.569703
H 0.921312 3.758886 0.138915
H 2.382430 2.531957 0.448071
H -3.589085 1.944120 -0.941116
H -3.725362 0.035649 -0.929401
H -2.287905 -2.561290 -1.311865
H -4.032619 -2.232218 -1.506126
H 3.726420 -1.562594 0.811046
H -0.970405 5.295425 -0.318839
H -3.219466 4.388640 -0.856115
H -4.382816 -3.054494 0.679131
H -3.232603 -1.836932 1.356446
H -1.560113 -3.380403 0.858226


%chk=000289037-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289037

0 1
Cl 4.858817 1.054313 0.939010
O -2.593321 -3.965626 0.616223
O 2.223450 -3.532251 0.046060
O 0.189292 -3.155489 1.002487
N -0.749827 -0.838531 -0.211360
N -2.953659 -0.550925 -0.826394
N 1.296088 -2.740992 0.480979
C -0.264442 1.993320 -0.150735
C 0.827275 1.048150 0.118504
C -1.578131 1.481898 -0.438984
C 0.497162 -0.360323 0.111806
C -1.747458 0.019231 -0.486266
C 1.552988 -1.290269 0.412561
C -0.078882 3.407424 -0.127318
C 2.160380 1.456224 0.380862
C -2.649444 2.390191 -0.675502
C -3.117376 -2.017488 -0.849558
C 2.877831 -0.880524 0.634402
C 3.155812 0.499131 0.621260
C -1.143948 4.285496 -0.370134
C -2.441667 3.776294 -0.643838
C -3.199180 -2.642657 0.581877
H 0.908150 3.826108 0.089208
H 2.433522 2.514207 0.393179
H -3.660993 2.021434 -0.880050
H -3.748463 0.043233 -1.051658
H -2.241843 -2.459348 -1.354227
H -4.019051 -2.250157 -1.442030
H 3.655464 -1.625409 0.819238
H -0.976060 5.367209 -0.344265
H -3.274739 4.462698 -0.826300
H -4.250215 -2.787899 0.884907
H -2.709747 -1.955879 1.299490
H -1.603382 -3.861793 0.650071


