%chk=000055165.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055165

0 1
 Cl  -3.163700       5.371400      0.9612000    
 O   0.1859000     -0.5320000       1.565400    
 N    4.550600     -0.3567000      0.1777000    
 N   0.9980000      -1.253700     -0.4854000    
 N   -2.061600      0.4322000      0.2697000    
 C    3.178500     -0.1616000     -0.2725000    
 C    2.369700      -1.434600     -7.1199998E-02
 C   -1.346500     -0.6905000     -0.3021000    
 C    5.185600      -1.450700     -0.5601000    
 C    5.325300      0.8761000      2.2299999E-02
 C   8.5000005E-03 -0.8113000      0.3811000    
 C   -2.155900      -1.960900     -0.1655000    
 C    6.594700      -1.708800     -5.4299999E-02
 C    4.684500       2.026400      0.7803000    
 C   -1.789500       1.751400     -4.4199999E-02
 C   -3.068000      -2.316900      -1.159200    
 C   -1.990100      -2.776900      0.9536000    
 C   -3.814400      -3.488600      -1.033500    
 C   -2.736500      -3.948600       1.079200    
 C   -2.527300       2.776000      0.5488000    
 C  -0.7781000       2.057100     -0.9549000    
 C   -3.648600      -4.304400      8.5500002E-02
 C   -2.253900       4.106400      0.2309000    
 C  -0.5048000       3.387300      -1.272800    
 C   -1.242600       4.412000     -0.6800000    
 H    2.673900      0.6179000      0.3085000    
 H    3.137600      0.1470000      -1.325900    
 H    2.718600      -2.263400     -0.6916000    
 H    2.387600      -1.752200      0.9778000    
 H   -1.196700     -0.5423000      -1.379500    
 H    4.664100      -2.397200     -0.3953000    
 H    5.204400      -1.263100      -1.640900    
 H    6.325300      0.7595000      0.4524000    
 H    5.447200       1.153300      -1.032400    
 H   0.7642000      -1.458000      -1.452500    
 H   -2.748500      0.2524000      0.9944000    
 H    7.305000     -0.9455000     -0.3865000    
 H    6.628600      -1.775900       1.038700    
 H    6.958000      -2.664000     -0.4505000    
 H    3.798400       2.420900      0.2733000    
 H    4.415500       1.741500       1.803300    
 H    5.395300       2.857700      0.8514000    
 H   -3.208500      -1.689100      -2.035000    
 H   -1.306600      -2.530400       1.758800    
 H   -4.525200      -3.765200      -1.806600    
 H   -2.611100      -4.582200       1.952400    
 H   -3.316400       2.536900       1.258800    
 H  -0.1694000       1.305700      -1.445400    
 H   -4.230700      -5.216000      0.1840000    
 H   0.2833000       3.626200      -1.981100    
 H   -1.018100       5.444000     -0.9372000    


%chk=000055165-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000055165

0 1
Cl -3.373116 5.577253 0.320505
O 0.354583 -0.315563 1.281209
N 4.627774 -0.336289 -0.059284
N 0.992692 -1.233980 -0.759364
N -2.121632 0.530335 0.001886
C 3.222378 -0.106735 -0.460265
C 2.402715 -1.419738 -0.365273
C -1.399691 -0.658985 -0.444128
C 5.508543 -0.713000 -1.194761
C 5.186743 0.728489 0.815316
C 0.062435 -0.701867 0.110686
C -2.159553 -1.917228 -0.010033
C 6.708429 -1.581158 -0.768370
C 4.612057 0.684229 2.244219
C -1.836392 1.829486 -0.421775
C -2.924716 -2.648179 -0.951637
C -2.135589 -2.339132 1.344691
C -3.654580 -3.789605 -0.550007
C -2.869819 -3.477405 1.745755
C -2.615037 2.911101 0.091531
C -0.813844 2.114804 -1.375697
C -3.629831 -4.206031 0.801145
C -2.356856 4.212635 -0.356716
C -0.593639 3.440317 -1.803266
C -1.360020 4.518730 -1.305061
H 2.754091 0.624854 0.220285
H 3.141310 0.312071 -1.492525
H 2.848065 -2.203192 -1.004729
H 2.435533 -1.767144 0.681273
H -1.349492 -0.646275 -1.554476
H 4.897408 -1.289728 -1.915648
H 5.874317 0.190122 -1.747333
H 6.280908 0.580417 0.869264
H 5.025803 1.744641 0.374111
H 0.691075 -1.530464 -1.689012
H -2.759183 0.406321 0.787870
H 7.369736 -1.048518 -0.061801
H 6.353000 -2.500814 -0.271814
H 7.316831 -1.861822 -1.648699
H 3.514377 0.810404 2.250984
H 4.843286 -0.286428 2.716673
H 5.047692 1.492684 2.860840
H -2.958962 -2.317370 -1.997049
H -1.526920 -1.785866 2.069545
H -4.242958 -4.348396 -1.286181
H -2.844304 -3.798809 2.792909
H -3.406494 2.724633 0.824761
H -0.177350 1.315059 -1.765053
H -4.196248 -5.090183 1.114192
H 0.197284 3.643312 -2.534027
H -1.187238 5.546606 -1.632267


