%chk=000139761.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139761

0 1
 O    2.445700       2.602700     -0.7717000    
 O    4.020300      -1.250200       1.328300    
 N  -0.2555000      -1.264000     -0.8512000    
 N    1.871700      -1.198600      0.4137000    
 N    3.395300      0.5958000      4.4100001E-02
 N   2.0999999E-03   1.465000     -9.0099998E-02
 C    1.076800     -0.6919000     -0.7161000    
 C    1.039300      0.7679000     -0.4104000    
 C   -1.369100     -0.5519000     -0.4224000    
 C   -1.232200      0.7976000     -3.5500001E-02
 C    2.376800       1.437000     -0.4155000    
 C    3.173000     -0.6815000      0.6342000    
 C  -0.3989000      -2.542100      -1.535900    
 C   -2.656500      -1.118400     -0.3606000    
 C    1.326300      -2.222600       1.297600    
 C   -2.347200       1.530600      0.4001000    
 C   -3.761600     -0.3824000      7.5199999E-02
 C   -3.606700      0.9429000      0.4572000    
 C    4.770100       1.054900     -8.9100003E-02
 C   -5.100100      -1.044200      0.1226000    
 C   -4.769600       1.753400      0.9254000    
 H    1.656400     -0.8352000      -1.637200    
 H   0.5721000      -2.921800      -1.873500    
 H   -1.032900      -2.440900      -2.423400    
 H  -0.8253000      -3.300200     -0.8703000    
 H   -2.808800      -2.156200     -0.6487000    
 H   0.3771000      -1.875800       1.714500    
 H    2.011600      -2.426100       2.125000    
 H    1.182300      -3.145600      0.7311000    
 H   -2.216400       2.571200      0.6912000    
 H    5.431800      0.2084000     -0.2950000    
 H    5.068200       1.512600      0.8593000    
 H    4.860300       1.795800     -0.8884000    
 H   -5.810600     -0.5245000     -0.5283000    
 H   -5.053000      -2.084400     -0.2183000    
 H   -5.487000      -1.057800       1.146800    
 H   -5.523800       1.837400      0.1363000    
 H   -5.221800       1.302600       1.814800    
 H   -4.471500       2.772100       1.197300    


%chk=000139761-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000139761

0 1
O 2.642200 2.668693 -0.742053
O 4.072609 -1.209831 1.353374
N -0.262434 -1.229874 -0.803898
N 1.914503 -1.232549 0.436624
N 3.419516 0.558419 -0.060972
N -0.032414 1.543707 -0.119661
C 1.068161 -0.659192 -0.690214
C 1.031270 0.843986 -0.433030
C -1.398692 -0.520381 -0.375574
C -1.270190 0.871090 -0.045097
C 2.392565 1.472186 -0.437488
C 3.174398 -0.685876 0.631027
C -0.408473 -2.539187 -1.458286
C -2.684435 -1.112615 -0.303980
C 1.516075 -2.433914 1.183761
C -2.412056 1.604605 0.355117
C -3.820641 -0.367319 0.092072
C -3.690058 1.018030 0.432953
C 4.814039 1.056080 -0.037337
C -5.175142 -1.047111 0.157216
C -4.893677 1.836078 0.863702
H 1.629670 -0.865645 -1.628651
H 0.538928 -2.798972 -1.959053
H -1.208400 -2.502581 -2.220936
H -0.646382 -3.349519 -0.741071
H -2.815919 -2.171761 -0.547560
H 0.467266 -2.342666 1.513604
H 2.174073 -2.516840 2.062679
H 1.630769 -3.358122 0.584106
H -2.260060 2.661896 0.596578
H 5.499112 0.214489 -0.216741
H 5.058136 1.503792 0.941594
H 4.914640 1.825907 -0.816529
H -5.906138 -0.553719 -0.511911
H -5.112146 -2.108835 -0.134596
H -5.602091 -0.999677 1.177519
H -5.678037 1.854168 0.082496
H -5.364281 1.424878 1.777810
H -4.607565 2.879784 1.075505


