%chk=000071758.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071758

0 1
 Cl  -8.794500      -1.536600      -1.038200    
 F    5.480600      -4.403400     -0.5929000    
 O   -2.344600     -0.3799000       2.470600    
 O    6.057500       2.553000      0.5246000    
 N   0.2685000       2.217600     -0.2326000    
 N   -3.394300      0.1946000      0.4157000    
 N   -4.527100      -1.089400       1.900200    
 N    4.374900      0.8875000      0.2855000    
 N    6.559200      0.2734000      0.1452000    
 C   -2.388800      0.9932000     -0.2398000    
 C   -1.115600      0.1829000     -0.4846000    
 C   -2.069000       2.244400      0.5778000    
 C  -1.0500000E-02   1.053600      -1.085100    
 C  -0.9317000       3.046900     -5.6600001E-02
 C    1.361400       3.012100     -0.7933000    
 C    2.659400       2.206200     -0.8979000    
 C   -4.649400     -9.9500000E-02 -0.1333000    
 C   -3.289700     -0.4153000       1.695000    
 C    3.174400       1.663800      0.4339000    
 C   -5.340000     -0.8888000      0.7843000    
 C   -5.211400      0.2630000      -1.339700    
 C   -6.615200      -1.352400      0.5475000    
 C    4.431300     -0.4982000      5.9300002E-02
 C   -6.506300     -0.1958000      -1.603100    
 C    5.705400       1.395800      0.3434000    
 C    5.772800     -0.8663000     -2.5300000E-02
 C   -7.200400     -0.9945000     -0.6700000    
 C    3.419300      -1.425900     -7.2499998E-02
 C    6.169400      -2.167000     -0.2438000    
 C    3.797300      -2.754400     -0.2948000    
 C    5.157100      -3.120700     -0.3795000    
 H   -2.762000       1.323300      -1.215400    
 H   -1.331100     -0.6545000      -1.160000    
 H  -0.7463000     -0.2612000      0.4481000    
 H   -1.783400       1.981800       1.603900    
 H   -2.962200       2.876100      0.6592000    
 H   0.8596000      0.3993000      -1.180500    
 H  -0.2974000       1.368000      -2.097200    
 H   -1.265200       3.461500      -1.017100    
 H  -0.7050000       3.894400      0.6018000    
 H    1.099100       3.402300      -1.785200    
 H    1.552500       3.879300     -0.1485000    
 H    2.582100       1.404900      -1.640900    
 H    3.427600       2.876900      -1.308100    
 H    3.402400       2.509800       1.093500    
 H    2.421100       1.054500      0.9439000    
 H   -4.787200      -1.628700       2.716800    
 H   -4.697600      0.8749000      -2.070300    
 H   -7.135500      -1.965500       1.274900    
 H   -6.975800      7.4299999E-02  -2.546700    
 H    7.571400      0.2864000      0.1285000    
 H    2.372300      -1.157200     -7.3000002E-03
 H    7.213900      -2.446900     -0.3084000    
 H    3.032500      -3.519100     -0.4040000    


%chk=000071758-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000071758

0 1
Cl -8.518602 -1.969862 -0.013207
F 3.151172 -4.343684 0.916830
O -1.004990 -1.388573 1.091009
O 6.397144 2.029880 -0.083175
N 0.489636 2.446127 -0.754734
N -2.796791 -0.188898 0.008114
N -3.291377 -2.102917 1.080041
N 4.221115 1.072567 0.253580
N 5.975268 -0.325956 0.175084
C -2.028212 0.961297 -0.525848
C -0.888022 0.492414 -1.464824
C -1.482344 1.853343 0.618817
C -0.033494 1.691889 -1.918891
C -0.622122 3.001383 0.048750
C 1.559925 3.409231 -1.123470
C 2.931665 2.697777 -1.198294
C -4.185229 -0.401664 -0.125781
C -2.214693 -1.239241 0.763802
C 3.425553 2.303250 0.218930
C -4.498191 -1.621285 0.554338
C -5.192393 0.339529 -0.768383
C -5.808090 -2.125644 0.607151
C 3.719604 -0.234786 0.425257
C -6.520064 -0.155195 -0.724798
C 5.626464 1.047666 0.091516
C 4.838552 -1.125124 0.381435
C -6.798122 -1.361522 -0.047917
C 2.413350 -0.710168 0.633370
C 4.675939 -2.511843 0.540911
C 2.229218 -2.105303 0.802220
C 3.351551 -2.952662 0.748978
H -2.743803 1.561225 -1.122934
H -1.316899 -0.019319 -2.347214
H -0.249649 -0.227977 -0.927567
H -0.859432 1.234464 1.288666
H -2.323897 2.264954 1.207597
H 0.814636 1.323914 -2.522936
H -0.642588 2.363276 -2.582168
H -1.269584 3.691008 -0.556671
H -0.201858 3.594111 0.881535
H 1.341420 3.920206 -2.091644
H 1.599851 4.201838 -0.350848
H 2.833744 1.785429 -1.815836
H 3.677741 3.344220 -1.696522
H 4.046788 3.111107 0.644558
H 2.546775 2.147499 0.870236
H -3.150705 -2.952396 1.622353
H -4.978444 1.274813 -1.293438
H -6.058496 -3.056076 1.122934
H -7.328109 0.395296 -1.213598
H 6.940620 -0.636892 0.100223
H 1.552344 -0.037082 0.664573
H 5.504584 -3.224026 0.515210
H 1.227337 -2.507117 0.973683


