%chk=000099719.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099719

0 1
 O    1.679800      0.3004000      -1.506800    
 O   0.1241000       2.498100      0.7389000    
 O   -1.740500       2.848300     -0.5003000    
 O   -2.974200      -2.154200       1.020100    
 O   -1.801000      -2.125000     -0.9232000    
 N   0.2590000     -4.5800000E-02  0.2944000    
 N    3.415800      -1.571700     -0.4640000    
 C  -0.9091000      0.5811000     -0.2796000    
 C   -2.195000     -3.8300000E-02  0.2751000    
 C    2.529800     -0.8551000      0.4498000    
 C    1.471500     -0.1348000     -0.3760000    
 C  -0.9041000       2.081500     -3.8400002E-02
 C    3.325000      0.1461000       1.278400    
 C   -2.281100      -1.530400      3.1500001E-02
 H  -0.8594000      0.4388000      -1.366200    
 H   -3.079200      0.4263000     -0.1758000    
 H   -2.243200      0.1400000       1.357200    
 H   0.2041000     -0.3627000       1.258300    
 H    2.049100      -1.586200       1.109300    
 H    2.667600      0.6799000       1.973700    
 H    3.807900      0.9001000      0.6461000    
 H    4.100800     -0.3548000       1.867500    
 H    4.129300      -2.065600      7.1500003E-02
 H    3.920800     -0.9067000      -1.049400    
 H   0.1083000       3.468900      0.8790000    
 H   -3.035200      -3.121600      0.8691000    


%chk=000099719-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099719

0 1
O 1.523005 -0.164203 -1.439922
O 0.267357 2.612486 0.594343
O -1.939096 2.777440 -0.103741
O -3.049384 -2.318185 0.651896
O -2.056580 -1.815451 -1.388702
N 0.297714 -0.083091 0.535156
N 3.428767 -1.755846 -0.220296
C -0.862875 0.551471 -0.082241
C -2.196160 -0.086383 0.370676
C 2.644336 -0.863280 0.638418
C 1.448806 -0.354716 -0.190022
C -0.932123 2.074241 0.130483
C 3.436293 0.373223 1.172131
C -2.392063 -1.461251 -0.240467
H -0.743037 0.397643 -1.176253
H -3.025228 0.562408 0.028996
H -2.268890 -0.154056 1.469632
H 0.311599 -0.207660 1.549125
H 2.254732 -1.426542 1.513813
H 2.814385 1.015243 1.824386
H 3.796894 0.983184 0.325078
H 4.309718 0.029795 1.756843
H 4.394494 -1.905067 0.079770
H 3.329363 -1.529895 -1.216496
H 0.180921 3.603506 0.646554
H -3.202047 -3.198415 0.211037


