%chk=000124400.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124400

0 1
 O    1.862100       2.208100     -0.4518000    
 O  -0.9023000     -0.3121000      -2.175300    
 O   0.7195000       1.972500      -2.410000    
 O   0.8312000      -1.718300      -2.637800    
 O    4.602000     -0.3969000       1.232200    
 O   -1.126100      -2.423200      0.2543000    
 O    2.818100      1.9400001E-02   2.588700    
 O   -1.922800       3.521500      0.8751000    
 N    1.121100      -1.279000      0.9898000    
 N   -3.824500      4.3000001E-03  0.6168000    
 C    1.106500      4.5100000E-02 -0.9936000    
 C   0.4869000     -7.2300002E-02  0.4141000    
 C    2.522300     -0.5381000     -0.8156000    
 C    2.518600      -1.232100      0.5442000    
 C   -1.029700     -4.3000001E-02  0.4847000    
 C    1.189100       1.495200      -1.387800    
 C   0.3635000     -0.7721000      -2.021900    
 C    3.292900     -0.4718000       1.575400    
 C   -1.704100       1.165500      0.6345000    
 C   -1.755500      -1.227800      0.4013000    
 C   -3.137200      -1.150900      0.4717000    
 C  -0.9814000       2.464400      0.7288000    
 C   -3.088100       1.135300      0.6945000    
 C   -3.962000      -2.393400      0.3876000    
 H   0.8405000      0.7370000       1.061300    
 H    3.296100      0.2367000     -0.8727000    
 H    2.793300      -1.267100      -1.586700    
 H    2.921100      -2.249000      0.4917000    
 H    1.040800      -1.293800       2.005100    
 H  -0.3056000       2.497900       1.586900    
 H  -0.4747000       2.693000     -0.1992000    
 H   -3.696600       2.025800      0.8096000    
 H    1.932500       3.156300     -0.6930000    
 H   -1.403100     -0.8314000      -2.839800    
 H    5.126700      0.1003000       1.895300    
 H  -0.1804000      -2.305700      8.2000002E-02
 H   -3.792200      -2.900800     -0.5675000    
 H   -3.712100      -3.074700       1.207200    
 H   -5.030100      -2.161800      0.4585000    
 H   -1.417000       4.350200      0.9314000    


%chk=000124400-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124400

0 1
O 1.699013 2.505984 -0.330310
O -0.285907 1.391317 -2.312796
O 3.140880 1.342987 -1.711501
O -0.245160 -0.915691 -2.550970
O 4.751022 -1.073213 0.648578
O -0.895972 -2.463092 0.709929
O 3.510389 0.503005 1.829172
O -2.592029 3.456014 0.624013
N 1.105364 -0.978677 1.359891
N -3.909667 -0.385864 0.387853
C 1.165690 0.153698 -0.811583
C 0.428710 0.163310 0.615269
C 2.007175 -1.154376 -0.814520
C 2.361149 -1.370225 0.677032
C -1.091154 -0.014458 0.583480
C 2.104915 1.363758 -1.012810
C 0.148837 0.112646 -1.973372
C 3.563347 -0.529872 1.123398
C -1.970901 1.108956 0.543252
C -1.673661 -1.317947 0.586895
C -3.089135 -1.469115 0.465834
C -1.447527 2.534540 0.608506
C -3.358613 0.866119 0.445250
C -3.700982 -2.847544 0.418791
H 0.679424 1.120986 1.099611
H 2.892518 -1.074204 -1.461820
H 1.371846 -1.984449 -1.164821
H 2.601856 -2.431022 0.868602
H 1.231042 -0.752722 2.356489
H -0.837204 2.664831 1.531507
H -0.789086 2.739343 -0.258439
H -4.050417 1.709547 0.416255
H 2.350448 3.238668 -0.503082
H -0.986028 1.335058 -3.018803
H 5.523410 -0.502389 0.910859
H 0.031150 -2.110305 1.049327
H -3.323069 -3.420443 -0.448328
H -3.429996 -3.432230 1.317315
H -4.795949 -2.755931 0.350563
H -2.256431 4.386204 0.615483


