%chk=000135860.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135860

0 1
 Cl  -1.150300      -4.749700       1.039500    
 F    4.286700      0.3814000      -2.385000    
 F    2.264700     -0.4298000      -2.294900    
 F    2.606200       1.702400      -1.955200    
 F   -3.194800       2.046300       1.081100    
 O   0.6411000       2.641300       2.873600    
 O    2.345600       2.554500      0.8984000    
 N    2.026500      0.2919000      0.4667000    
 N  -0.6631000       1.484100       1.188800    
 C    1.226800     -0.8974000      0.5737000    
 C  -0.1780000     -0.8713000      0.6862000    
 C  -0.9644000      0.3910000      0.5742000    
 C    3.291800      0.2026000     -0.2628000    
 C    1.700700       1.515900       1.068700    
 C   0.5213000       1.497100       2.030900    
 C    1.855200      -2.158200      0.5507000    
 C  -0.9043000      -2.065100      0.8474000    
 C   -2.166200      0.4168000     -0.3088000    
 C    3.104700      0.4671000      -1.735600    
 C    1.125500      -3.341400      0.6914000    
 C  -0.2524000      -3.294300      0.8518000    
 C   -3.230500       1.256000     -1.4000000E-03
 C   -2.207500     -0.4005000      -1.432000    
 C   -4.353000       1.277800     -0.8292000    
 C   -3.329900     -0.3787000      -2.259900    
 C   -4.402600      0.4603000      -1.958300    
 H    3.969000      0.9727000      0.1278000    
 H    3.833100     -0.7280000     -0.1015000    
 H   0.5762000      0.6332000       2.701600    
 H    2.929500      -2.285700      0.4883000    
 H   -1.985100      -2.039100      0.9725000    
 H    1.653600      -4.291800      0.6905000    
 H   -1.377600      -1.040300      -1.717000    
 H   0.4024000       3.414200       2.333900    
 H   -5.187900       1.931500     -0.5946000    
 H   -3.365700      -1.009000      -3.143700    
 H   -5.275800      0.4786000      -2.603900    


%chk=000135860-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000135860

0 1
Cl -1.151315 -4.847442 1.130270
F 3.772424 0.397813 -2.774181
F 1.939457 -0.839414 -2.252242
F 1.837416 1.419516 -2.148634
F -3.470820 1.664087 1.280370
O 0.604151 2.574578 3.046499
O 2.533530 2.505242 1.066705
N 2.063641 0.270957 0.531608
N -0.584034 1.508792 1.238560
C 1.273898 -0.921575 0.725186
C -0.155094 -0.876537 0.696945
C -0.910944 0.415078 0.584141
C 3.170828 0.274569 -0.436913
C 1.827788 1.475277 1.226610
C 0.585462 1.462543 2.149681
C 1.934903 -2.165022 0.887224
C -0.881239 -2.092550 0.812801
C -2.093843 0.448006 -0.326360
C 2.675641 0.320269 -1.886447
C 1.208811 -3.362893 1.012308
C -0.200125 -3.307530 0.970029
C -3.305805 1.103062 0.006152
C -2.019686 -0.155425 -1.612815
C -4.395930 1.182289 -0.876543
C -3.095932 -0.083342 -2.520441
C -4.285381 0.589203 -2.153329
H 3.763996 1.188122 -0.257474
H 3.822124 -0.607470 -0.333622
H 0.585152 0.560512 2.793506
H 3.027896 -2.203106 0.928947
H -1.974017 -2.069446 0.782702
H 1.725380 -4.317448 1.145175
H -1.093550 -0.663008 -1.904127
H 0.875212 3.386017 2.540090
H -5.307054 1.695802 -0.556258
H -3.005714 -0.542603 -3.509707
H -5.125725 0.649476 -2.852515


