%chk=000279449.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279449

0 1
Cl -6.193116 1.002560 -0.422858
O -1.829682 -1.407728 -0.752673
N -0.204255 -0.590188 0.688454
N -2.476767 0.134746 0.838683
C 3.280554 0.671506 0.034256
C 2.850453 -0.222324 1.225834
C 2.049464 0.988453 -0.852827
C 0.896987 -1.184036 -0.133246
C 2.093084 -1.480428 0.790736
C 1.303897 -0.268799 -1.305035
C 3.844287 1.996559 0.589456
C 4.376034 -0.024365 -0.792155
C -1.519355 -0.674942 0.175245
C -3.910917 -0.067582 0.522268
C -4.421684 1.172024 -0.218296
H 2.225795 0.367560 1.921945
H 3.743623 -0.516379 1.809176
H 2.370814 1.564697 -1.741150
H 1.359352 1.654743 -0.303010
H 0.501939 -2.151601 -0.553841
H 2.782093 -2.166240 0.258254
H 1.747772 -2.036674 1.684968
H 0.404587 0.011412 -1.889278
H 1.937056 -0.849712 -2.004770
H 4.164183 2.662790 -0.218540
H 3.105609 2.538944 1.186335
H 4.717129 1.822884 1.227182
H 4.022952 -0.974105 -1.207631
H 4.700517 0.598068 -1.632103
H 5.260253 -0.241513 -0.184868
H 0.067941 0.235746 1.219019
H -2.276791 0.530467 1.750663
H -4.043083 -0.976185 -0.121556
H -4.494434 -0.245177 1.452372
H -3.966940 1.263819 -1.223728
H -4.231750 2.107997 0.336718


%chk=000279449-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000279449

0 1
Cl -6.110021 1.169478 -0.595501
O -1.883686 -1.234320 -0.913767
N -0.219562 -0.601066 0.603292
N -2.472684 -0.018657 0.996429
C 3.250883 0.696197 0.024855
C 2.804624 -0.219871 1.206673
C 2.023714 0.960325 -0.902328
C 0.876444 -1.221268 -0.178673
C 2.078591 -1.511084 0.751446
C 1.311267 -0.327849 -1.371980
C 3.758409 2.044839 0.595762
C 4.407608 0.032203 -0.770496
C -1.535745 -0.652156 0.162084
C -3.899664 -0.028749 0.652717
C -4.250237 1.171041 -0.244696
H 2.141927 0.372710 1.875580
H 3.687819 -0.489234 1.819679
H 2.349055 1.552582 -1.780601
H 1.294130 1.590563 -0.351551
H 0.474597 -2.169294 -0.581396
H 2.786828 -2.157102 0.199634
H 1.740484 -2.092761 1.631238
H 0.418336 -0.082760 -1.974905
H 1.980797 -0.923345 -2.023694
H 4.077321 2.724464 -0.217364
H 2.964754 2.557932 1.172615
H 4.624553 1.893803 1.268564
H 4.116469 -0.937247 -1.211888
H 4.735526 0.689379 -1.598004
H 5.280790 -0.145769 -0.114073
H 0.020863 -0.118153 1.469570
H -2.175106 0.451970 1.851337
H -4.121866 -0.963236 0.111582
H -4.504009 -0.003144 1.576651
H -3.754398 1.098793 -1.223043
H -4.041210 2.137784 0.238252


