%chk=000157555.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157555

0 1
 Cl   3.504900      0.9721000       2.963800    
 F   -4.462900       2.477100      -1.449300    
 F   -4.569400      0.3278000      -1.719800    
 F   -5.179100       1.214500      0.1699000    
 F    6.907300      -1.131200     -0.3734000    
 F    5.690200      -2.500200      -1.534700    
 F    6.127800     -0.5153000      -2.307800    
 O   -3.342500      -1.014400      0.5739000    
 O   0.4239000      -1.376400       1.995400    
 O   -1.588300      -2.209600       1.720100    
 O  -0.1392000       4.183700     -0.8122000    
 O    1.436500       3.072400      0.2370000    
 N    1.084700      0.8247000       1.179400    
 N  -0.7493000      -1.293100       1.566800    
 N   0.2657000       3.169200     -0.1984000    
 N    2.205100     -0.1586000     -0.6558000    
 C   -4.456800      -3.055900     -8.8200003E-02
 C   -3.396400      -2.009100     -0.4403000    
 C   -2.445000      5.2999998E-03  0.3921000    
 C   -1.145400     -0.1089000      0.8781000    
 C   -2.845600       1.155200     -0.2829000    
 C  -0.2396000      0.9345000      0.6878000    
 C  -0.6368000       2.088300      1.1900000E-02
 C   -1.939800       2.198700     -0.4734000    
 C   -5.847700      -2.426900      1.7000001E-02
 C   -4.459500      -4.180100      -1.121900    
 C   -4.235600       1.291300     -0.8123000    
 C    2.268200      0.3273000      0.6109000    
 C    3.442600      0.3518000       1.357600    
 C    4.568600     -0.6486000     -0.5176000    
 C    4.604800     -0.1451000      0.7780000    
 C    3.354700     -0.6331000      -1.185800    
 C    5.794000      -1.187400      -1.165700    
 H   -4.214700      -3.482100      0.8936000    
 H   -2.421100      -2.499400     -0.5482000    
 H   -3.620300      -1.567600      -1.415200    
 H   -2.267800       3.089600      -1.003100    
 H   -6.597800      -3.184600      0.2672000    
 H   -6.142900      -1.957400     -0.9275000    
 H   -5.877900      -1.661400      0.7993000    
 H   -5.194800      -4.948000     -0.8594000    
 H   -3.477900      -4.662500      -1.174300    
 H   -4.705900      -3.802600      -2.120200    
 H    1.097800      0.7822000       2.196600    
 H    5.537400     -0.1392000       1.336800    
 H    3.264800      -1.012800      -2.198900    


%chk=000157555-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157555

0 1
Cl 3.286201 -0.495424 3.254476
F -3.731882 2.278797 -2.342561
F -4.059763 0.084031 -2.781623
F -4.925991 1.009213 -0.900193
F 7.451963 0.494475 0.062905
F 6.750833 -0.584071 -1.807918
F 6.596320 1.668818 -1.687875
O -3.474062 -1.158576 0.351883
O -0.313549 -1.807435 2.448015
O -1.536927 -2.951540 0.907162
O 0.782600 3.135093 -1.673058
O 1.495558 2.726569 0.453316
N 1.160558 -0.062304 1.092776
N -1.013592 -1.866418 1.348365
N 0.768878 2.457435 -0.577332
N 2.664529 0.417524 -0.682027
C -5.073997 -2.999971 0.358894
C -4.203338 -2.128729 -0.550880
C -2.414191 -0.399984 -0.074164
C -1.155241 -0.630183 0.562491
C -2.508402 0.685746 -0.995318
C -0.017764 0.235122 0.414583
C -0.200704 1.343723 -0.471429
C -1.395097 1.524209 -1.184205
C -6.128389 -2.155272 1.107542
C -5.734687 -4.103571 -0.504579
C -3.780846 1.011304 -1.728523
C 2.467529 0.119478 0.633491
C 3.571266 -0.080897 1.511264
C 5.066463 0.362957 -0.336351
C 4.878815 0.040019 1.028128
C 3.925733 0.544499 -1.154931
C 6.440458 0.486819 -0.923327
H -4.402753 -3.479721 1.097554
H -3.434206 -2.723318 -1.075596
H -4.815923 -1.559127 -1.270296
H -1.461808 2.386164 -1.853320
H -6.716562 -2.790362 1.794025
H -6.831285 -1.681068 0.395729
H -5.650906 -1.356112 1.700211
H -6.365020 -4.752276 0.129035
H -4.982525 -4.744278 -1.001206
H -6.384717 -3.664432 -1.285391
H 1.030770 -0.582923 1.977360
H 5.733769 -0.102147 1.694084
H 4.020885 0.802344 -2.214285


