%chk=000187101.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187101

0 1
Cl 7.302390 -2.483052 -0.544617
O -4.068994 0.238057 1.617553
O 0.765817 2.081184 -0.301034
O -4.760589 -1.565197 -1.039987
O -6.381814 -0.123802 -0.388211
N 2.007347 0.081112 -0.042347
N 4.248287 1.597623 -0.985294
C -4.707132 -1.007142 1.236901
C -2.839370 0.560040 1.067789
C -0.414360 1.460802 0.183820
C 3.266617 -0.508897 -0.166334
C -2.270281 1.696932 1.682614
C -2.209676 -0.122040 0.020933
C -5.723653 -1.242505 2.337136
C 4.383620 0.249413 -0.637284
C -1.035311 2.150857 1.237239
C -0.967246 0.336542 -0.428876
C 1.924854 1.366094 -0.377909
C -5.420975 -0.788599 -0.109965
C 3.436097 -1.884486 0.182073
C 5.661081 -0.373514 -0.757533
C 3.060875 2.152706 -0.864124
C 4.673460 -2.468191 0.060397
C 5.774612 -1.698741 -0.411302
C -5.237648 -1.514670 -2.411345
H -3.948593 -1.820410 1.163309
H -6.259645 -2.189927 2.202948
H -5.235333 -1.260196 3.322661
H -6.472217 -0.432978 2.372343
H -2.805200 2.194418 2.490757
H -2.669385 -0.988374 -0.457343
H -0.554212 3.022035 1.680778
H -0.439718 -0.177527 -1.232435
H 2.567616 -2.440848 0.542281
H 6.509133 0.214400 -1.118403
H 2.917533 3.207899 -1.127320
H 4.830545 -3.517275 0.320686
H -4.869896 -0.591620 -2.870289
H -6.332192 -1.552542 -2.436490
H -4.786545 -2.405080 -2.861173


%chk=000187101-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187101

0 1
Cl 7.279602 -2.485662 -1.837331
O -4.426069 0.689063 1.484726
O 0.990186 2.007688 0.671796
O -4.577332 -2.171720 -0.587382
O -5.567770 -0.136812 -1.158679
N 2.076026 0.000644 -0.067567
N 4.475544 1.596123 -0.199290
C -5.006896 -0.636409 1.216472
C -3.054374 0.889312 1.229980
C -0.342981 1.520294 0.829073
C 3.286830 -0.557774 -0.472238
C -2.585478 2.198115 1.506764
C -2.161823 -0.098807 0.752266
C -6.415845 -0.601207 1.819591
C 4.492217 0.239333 -0.540929
C -1.233398 2.512683 1.305681
C -0.796043 0.213432 0.550126
C 2.098926 1.299500 0.250626
C -5.086434 -0.901051 -0.299921
C 3.345031 -1.938448 -0.826318
C 5.719061 -0.351941 -0.960360
C 3.303166 2.105561 0.186956
C 4.553762 -2.511886 -1.236710
C 5.725985 -1.704494 -1.297708
C -4.655634 -2.587429 -2.012233
H -4.390836 -1.426711 1.685428
H -6.921744 -1.572736 1.680153
H -6.348997 -0.387422 2.899139
H -7.012363 0.188384 1.333598
H -3.293788 2.946949 1.871857
H -2.501729 -1.113512 0.525174
H -0.850811 3.516852 1.509373
H -0.098210 -0.539626 0.185832
H 2.428768 -2.533065 -0.768951
H 6.616093 0.270732 -1.004818
H 3.256600 3.163960 0.461224
H 4.607968 -3.569557 -1.510023
H -4.059701 -1.901549 -2.636925
H -5.703924 -2.572749 -2.354175
H -4.243687 -3.605556 -2.031676


