%chk=000024743.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000024743

0 1
 O   -1.104000      -1.133400       1.050400    
 O    5.357700       1.477800      0.2579000    
 O   -1.685000     -0.1164000     -0.9482000    
 O    5.259400     -0.5590000     -0.7775000    
 N    3.403000      0.3592000      0.3232000    
 N   -3.211400     -0.3180000      0.8217000    
 C    2.402700     -0.5986000      0.1543000    
 C   0.1685000      -1.348000      0.5107000    
 C    1.133800     -0.3839000      0.6926000    
 C    2.671900      -1.771500     -0.5511000    
 C   0.4033000      -2.515100     -0.1803000    
 C    1.672300      -2.729700     -0.7184000    
 C   -4.373600      0.2800000      0.3333000    
 C   -5.514600      0.3431000       1.133400    
 C   -4.394600      0.8155000     -0.9546000    
 C   -1.982800     -0.4778000      0.1846000    
 C    4.719200      0.3304000     -0.1312000    
 C   -6.676400      0.9412000      0.6456000    
 C   -5.556400       1.413700      -1.442300    
 C   -6.697400       1.476600     -0.6422000    
 C    6.729600       1.598400     -0.1356000    
 C    7.274700       2.915600      0.3737000    
 H   0.9103000      0.5243000       1.245200    
 H    3.628900      -2.006900     -0.9956000    
 H  -0.3747000      -3.260800     -0.3097000    
 H    1.880500      -3.643500      -1.267500    
 H    3.137800       1.189500      0.8476000    
 H   -3.266400     -0.6868000       1.768200    
 H   -5.512400     -6.9899999E-02   2.139000    
 H   -3.551300      0.8042000      -1.631200    
 H   -7.564800      0.9903000       1.268400    
 H   -5.574100       1.831100      -2.445000    
 H   -7.601900       1.942400      -1.022000    
 H    6.799600       1.566700      -1.228500    
 H    7.305600      0.7697000      0.2910000    
 H    7.194300       2.970000       1.464400    
 H    6.696800       3.753600     -2.9700000E-02
 H    8.323500       3.040800      9.0200000E-02


%chk=000024743-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000024743

0 1
O -1.246595 -1.502781 0.197380
O 5.192092 1.537246 -0.146833
O -1.408500 0.864206 -0.071091
O 5.512867 -0.786329 0.083521
N 3.363749 0.223511 -0.005190
N -3.279318 -0.576247 0.113198
C 2.481134 -0.883555 0.111635
C 0.171264 -1.646830 0.201681
C 1.091209 -0.585816 0.089022
C 2.936552 -2.220257 0.245121
C 0.598221 -2.987109 0.335337
C 1.981570 -3.254021 0.354907
C -4.386389 0.313873 0.021159
C -5.684488 -0.258786 0.095464
C -4.240455 1.716881 -0.138251
C -1.933961 -0.265386 0.063444
C 4.750075 0.207303 -0.011754
C -6.826653 0.562222 0.011086
C -5.395548 2.524046 -0.221418
C -6.690125 1.961052 -0.148460
C 6.672012 1.714535 -0.168908
C 6.930683 3.210474 -0.315860
H 0.734308 0.441042 -0.014913
H 4.007111 -2.430572 0.261334
H -0.146043 -3.783327 0.420193
H 2.325929 -4.288510 0.458003
H 2.944271 1.151532 -0.096555
H -3.485410 -1.570983 0.229082
H -5.798414 -1.343541 0.218466
H -3.242119 2.154908 -0.194775
H -7.821916 0.108294 0.069757
H -5.277500 3.606420 -0.344567
H -7.577356 2.599284 -0.214358
H 7.082441 1.130238 -1.012360
H 7.087682 1.304242 0.769318
H 6.495461 3.770956 0.529102
H 6.494406 3.596513 -1.252977
H 8.019349 3.400071 -0.335141


