%chk=000090760.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090760

0 1
 Cl  -6.659000       2.397400      2.2700001E-02
 O   -3.563900     -0.6167000       2.672200    
 O   -4.756200       1.689100      -2.194500    
 O   -1.043600      -1.094100      -1.732500    
 O    1.676100       1.565900     -0.3447000    
 O    1.131500      -4.012000      -1.529700    
 O    7.560200       1.075900      0.1606000    
 O    6.468500       2.807700     -0.6321000    
 N   -1.916900      -1.138300      0.4467000    
 N    1.324400      -1.679900     -0.2607000    
 N    1.630700      -1.018000      0.7523000    
 N    6.487800       1.653800     -0.1397000    
 C   6.6399999E-02  -2.406100     -6.8899997E-02
 C   -3.050200     -0.2953000      0.3505000    
 C   -1.023500      -1.473000     -0.5641000    
 C   -3.851600     -5.1199999E-02   1.465800    
 C   -3.361800      0.2939000     -0.8748000    
 C   -4.474900       1.127100     -0.9848000    
 C   -4.964800      0.7821000       1.355700    
 C   0.1520000      -3.704500     -0.8507000    
 C   -5.276400       1.371300      0.1304000    
 C    2.840500     -0.3411000      0.5246000    
 C    2.844100      0.9426000     -2.1199999E-02
 C   -1.035300      -4.628900     -0.7480000    
 C    4.045400     -0.9640000      0.8502000    
 C    4.052500       1.603500     -0.2414000    
 C    5.257400      0.9806000      8.3999999E-02
 C    5.253800     -0.3031000      0.6298000    
 C   -2.706800      0.1177000       3.543400    
 C   -4.169100       2.958800      -2.470500    
 C    1.062800       2.358800      0.6695000    
 H  -6.9600001E-02  -2.680400      0.9851000    
 H   -1.761200      -1.535000       1.370300    
 H   -2.790800      0.1492000      -1.780600    
 H   -5.584900      0.9667000       2.229900    
 H   -1.234600      -4.855600      0.3023000    
 H  -0.8192000      -5.564100      -1.272100    
 H   -1.910000      -4.161800      -1.206400    
 H    4.053000      -1.963600       1.276800    
 H    4.024800       2.603100     -0.6690000    
 H    6.172900     -0.8189000      0.8958000    
 H   -1.741300      0.3148000       3.066700    
 H   -3.178800       1.060700       3.836800    
 H   -2.536400     -0.4819000       4.441700    
 H   -4.544300       3.306500      -3.437000    
 H   -3.079900       2.867700      -2.531300    
 H   -4.439700       3.693600      -1.705900    
 H   0.1385000       2.778700      0.2631000    
 H    1.721800       3.181700      0.9640000    
 H   0.8131000       1.746000       1.541400    


%chk=000090760-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000090760

0 1
Cl -5.964857 3.160104 -0.413382
O -1.338387 1.431402 1.441980
O -5.966266 0.273143 -1.559147
O -2.177105 -2.787696 -0.997518
O 2.085797 1.005893 2.867461
O -0.059113 -5.270945 0.548327
O 6.136436 2.566104 -1.217774
O 5.683206 3.583991 0.773476
N -1.577138 -0.936228 0.325141
N 1.095022 -2.024489 0.010663
N 1.325143 -1.130451 0.938060
N 5.481035 2.665935 -0.110313
C -0.078895 -2.867202 0.352214
C -2.645423 -0.034924 0.090740
C -1.395767 -2.196806 -0.200663
C -2.518039 1.253809 0.696973
C -3.790082 -0.328990 -0.679159
C -4.807794 0.640076 -0.851681
C -3.523158 2.224141 0.532050
C 0.090972 -4.294521 -0.225731
C -4.658891 1.906440 -0.241575
C 2.404467 -0.234068 0.671741
C 2.695725 0.785666 1.642799
C 0.420066 -4.420043 -1.692815
C 3.173072 -0.285671 -0.532722
C 3.710069 1.739323 1.359987
C 4.423169 1.655539 0.158711
C 4.179401 0.642512 -0.804507
C -1.073799 2.757474 2.014968
C -6.043630 0.778393 -2.948077
C 1.260177 -0.001077 3.568738
H -0.204865 -2.950418 1.451264
H -0.827725 -0.564901 0.928062
H -3.907101 -1.311159 -1.141154
H -3.445156 3.210494 0.994923
H -0.470481 -4.114636 -2.274724
H 0.682637 -5.459530 -1.939542
H 1.240393 -3.731099 -1.960737
H 2.927735 -1.075746 -1.248044
H 3.932456 2.521565 2.089072
H 4.767994 0.616112 -1.723973
H -1.051069 3.528174 1.221975
H -1.835546 3.017937 2.773729
H -0.083156 2.674112 2.485268
H -7.003564 0.408624 -3.337594
H -5.208218 0.374249 -3.551624
H -6.028774 1.883744 -2.971781
H 1.240530 0.354154 4.610753
H 1.716556 -1.002186 3.504346
H 0.245443 -0.028918 3.142516


