%chk=000125900.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125900

0 1
 O    3.831800      -1.547500     -0.6767000    
 O    4.071600       1.681900      0.7546000    
 N   -2.023500      0.7779000     -8.1000000E-02
 N   -1.510800      -1.396100      0.1158000    
 N   0.2245000       1.706200     -0.2609000    
 N    3.304500     -0.3238000     -0.1794000    
 C  -0.3609000     -0.6575000     -2.7000001E-03
 C  -0.6527000      0.6940000     -0.1261000    
 C   -2.500500     -0.5241000      6.7500003E-02
 C   0.9861000      -1.042900     -1.6799999E-02
 C   -3.926400     -0.7164000      0.1424000    
 C    1.939000     -3.4899998E-02 -0.1542000    
 C   -2.848700       1.894100     -0.1600000    
 C    1.511000       1.282900     -0.2687000    
 C    1.399500      -2.473200      0.1096000    
 C   -4.713500      0.3832000      6.3400000E-02
 C   -4.176900       1.724800     -9.1200002E-02
 C   -4.555700      -2.076100      0.3024000    
 C    4.285400      0.5648000      0.2835000    
 C    5.716400      8.2699999E-02  0.1786000    
 H   -2.386600       2.866900     -0.2750000    
 H    2.195600       2.105800     -0.4472000    
 H   0.5461000      -3.097400      0.3989000    
 H    1.762500      -2.862000     -0.8466000    
 H    2.153200      -2.606600      0.8922000    
 H   -5.795600      0.3042000      0.1135000    
 H   -4.863200       2.561000     -0.1477000    
 H   -5.649100      -2.029200      0.3403000    
 H   -4.208700      -2.545500       1.228900    
 H   -4.277600      -2.721500     -0.5375000    
 H    5.848400     -0.8332000      0.7611000    
 H    5.976300     -9.6699998E-02 -0.8683000    
 H    6.391100      0.8462000      0.5772000    
 H    3.848200      -1.348900      -1.628900    


%chk=000125900-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125900

0 1
O 3.775576 -1.194859 -1.305849
O 3.927926 1.066944 1.507886
N -2.080377 0.845500 -0.193948
N -1.500486 -1.377075 0.166296
N 0.172584 1.801566 -0.500342
N 3.340297 -0.155954 -0.365271
C -0.352665 -0.603451 -0.047643
C -0.679295 0.777516 -0.271540
C -2.532471 -0.493348 0.076243
C 1.018311 -0.981093 -0.047962
C -3.943707 -0.720905 0.211979
C 1.924174 0.082667 -0.308032
C -2.936241 1.927166 -0.327487
C 1.478137 1.426804 -0.524378
C 1.444943 -2.399979 0.226662
C -4.794609 0.379276 0.072466
C -4.296399 1.703877 -0.196361
C -4.420673 -2.124436 0.496289
C 4.286967 0.297237 0.572212
C 5.714147 -0.181573 0.357948
H -2.469115 2.893715 -0.526909
H 2.216703 2.215578 -0.694228
H 0.599387 -2.973616 0.636838
H 1.794912 -2.894131 -0.697513
H 2.292498 -2.426976 0.935026
H -5.875245 0.230278 0.172085
H -4.986493 2.544925 -0.297345
H -5.519630 -2.164749 0.579434
H -3.976411 -2.505213 1.433993
H -4.096086 -2.816779 -0.301830
H 5.773676 -1.282542 0.396537
H 6.099395 0.128945 -0.629623
H 6.341122 0.255801 1.148842
H 3.799949 -0.738015 -2.193477


