%chk=000038778.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038778

0 1
 Cl -0.5625000      0.9445000      -1.809000    
 O   -1.238400      -1.644800     -0.4384000    
 O   -6.226800       1.684100       1.667600    
 N    4.115400     -0.1310000      2.1100000E-02
 N    5.852000       1.422300      0.9141000    
 N    6.297500      1.7000000E-03 -0.9170000    
 N    4.767200      -1.497800      -1.794600    
 N    7.892100       1.546000     -0.1555000    
 N   -5.784900       2.213400     -0.5660000    
 C    4.508900      0.8338000       1.072800    
 C    3.553500       2.042100       1.113700    
 C    4.532800      0.1501000       2.450900    
 C    2.761900     -0.5064000     -9.9100001E-02
 C    5.094000     -0.5109000     -0.8917000    
 C    6.639800      0.9949000     -2.3499999E-02
 C    1.854000      0.2975000     -0.8089000    
 C    2.291800      -1.693100      0.4885000    
 C   6.4300001E-02  -1.256000     -0.3382000    
 C   0.5148000     -7.4600004E-02 -0.9276000    
 C   0.9529000      -2.065100      0.3700000    
 C   -1.963400      -1.798900      0.7795000    
 C   -3.416700      -1.528700      0.5220000    
 C   -3.911300     -0.2361000      0.6556000    
 C   -5.262600      1.4400000E-02  0.4171000    
 C   -4.256000      -2.574000      0.1530000    
 C   -6.110600      -1.029400      4.6399999E-02
 C   -5.607300      -2.323500     -8.5800000E-02
 C   -5.788200       1.363400      0.5550000    
 C   -6.308200       3.571100     -0.5110000    
 C   -5.256000       1.791000      -1.861000    
 H    3.900100       2.784600       1.843800    
 H    3.515200       2.551600      0.1444000    
 H    2.536700       1.765900       1.410500    
 H    4.878200      0.8374000       3.232100    
 H    3.540800     -0.2108000       2.742300    
 H    5.211800     -0.7108000       2.447100    
 H    2.203900       1.208800      -1.289300    
 H    2.973600      -2.336100       1.040400    
 H   0.6203000      -2.993200      0.8266000    
 H    5.447700      -1.816000      -2.476600    
 H    3.858500      -1.945000      -1.818600    
 H   -1.591700      -1.114700       1.554600    
 H   -1.828000      -2.821100       1.153800    
 H    8.211500       2.280200      0.4669000    
 H    8.530900       1.232600     -0.8780000    
 H   -3.249400      0.5779000      0.9418000    
 H   -3.874200      -3.585400      4.5200001E-02
 H   -7.165100     -0.8455000     -0.1425000    
 H   -6.267500      -3.136000     -0.3751000    
 H   -5.506800       4.270000     -0.7671000    
 H   -6.683300       3.807100      0.4880000    
 H   -7.125300       3.665100      -1.231900    
 H   -4.866200      0.7736000      -1.873900    
 H   -4.447700       2.473400      -2.142000    
 H   -6.059000       1.863300      -2.601100    


%chk=000038778-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000038778

0 1
Cl -0.585218 1.679967 -1.620225
O -1.482202 -0.688583 -0.090254
O -7.334026 1.395115 0.677665
N 4.144917 0.105350 0.023905
N 6.058285 1.490753 0.784440
N 6.257057 -0.043794 -1.123441
N 4.417815 -1.229250 -1.925464
N 7.932461 1.500006 -0.625355
N -5.765514 2.025308 -0.929094
C 4.845298 0.788046 1.226102
C 3.889445 1.822040 1.849820
C 5.226000 -0.310677 2.258736
C 2.727723 -0.135783 0.013641
C 4.968018 -0.376832 -0.988842
C 6.700314 0.985146 -0.261824
C 1.871782 0.747892 -0.700252
C 2.155861 -1.233594 0.701808
C -0.098908 -0.562669 -0.011312
C 0.488301 0.529651 -0.707192
C 0.760004 -1.443776 0.694248
C -2.129072 -1.750931 0.704796
C -3.629605 -1.612669 0.536735
C -4.215419 -0.353382 0.271270
C -5.621298 -0.221792 0.163050
C -4.458322 -2.750138 0.687399
C -6.445410 -1.359094 0.358511
C -5.863699 -2.619082 0.607496
C -6.301661 1.115933 -0.018964
C -6.333410 3.384400 -0.979837
C -4.789806 1.707939 -1.987312
H 4.431204 2.329080 2.664860
H 3.608225 2.584836 1.104383
H 2.977812 1.354490 2.260513
H 5.794623 0.154442 3.082588
H 4.329368 -0.798669 2.684049
H 5.868529 -1.074744 1.785505
H 2.301342 1.599097 -1.235755
H 2.807736 -1.926160 1.243046
H 0.345424 -2.299894 1.233792
H 5.016572 -1.506557 -2.698914
H 3.470945 -1.587854 -1.840651
H -1.832352 -1.626934 1.768317
H -1.783825 -2.745435 0.356565
H 8.342720 2.242764 -0.067322
H 8.367595 1.170946 -1.481577
H -3.562939 0.516301 0.154245
H -4.012408 -3.735151 0.874554
H -7.532283 -1.233987 0.324704
H -6.501520 -3.499713 0.738430
H -5.521354 4.134535 -0.941702
H -7.007351 3.515225 -0.120297
H -6.912800 3.537558 -1.911659
H -4.645227 0.622108 -2.076594
H -3.805342 2.177111 -1.794414
H -5.169407 2.088008 -2.955523


