%chk=000027293.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027293

0 1
 O   -4.744000       4.835400     -0.3331000    
 O    6.581300      2.2000000E-03  0.4430000    
 N   -1.126400     -0.4063000     -0.5647000    
 N   -2.402200      -3.882600     -0.1009000    
 N   0.1342000       1.339400     -1.3600000E-02
 N    1.139100     -0.8533000     -0.3998000    
 C   -1.582100      -1.729300     -0.9235000    
 C   -1.923400      -2.567300      0.3053000    
 C   -1.919200      0.7064000     -0.4015000    
 C   9.7199999E-02  8.6000003E-03 -0.3245000    
 C   -1.151300       1.814900     -5.5599999E-02
 C   -3.808400      -3.818100     -0.5041000    
 C   -2.229400      -4.852100      0.9826000    
 C   -3.310800      0.8509000     -0.5319000    
 C   -1.691900       3.080900      0.1722000    
 C   -3.078600       3.206700      3.7900001E-02
 C   -4.301800      -5.169200     -0.9932000    
 C   -3.054400      -4.468600       2.199200    
 C   -3.875600       2.112800     -0.3078000    
 C    2.528200     -0.6348000     -0.1851000    
 C   -3.700700       4.502800      0.2630000    
 C    3.006200      0.6583000      2.7600000E-02
 C    3.412400      -1.713700     -0.1871000    
 C   -3.081300       5.492000       1.243600    
 C    4.368200      0.8724000      0.2386000    
 C    4.774500      -1.499600      2.3900000E-02
 C    5.252300     -0.2065000      0.2368000    
 C    7.116600       1.253100      1.3600000E-02
 C    8.571200       1.064600     -0.3608000    
 H   -2.443700      -1.597800      -1.585800    
 H  -0.8149000      -2.214300      -1.537600    
 H   -1.005500      -2.659800      0.9017000    
 H   -2.647900      -2.032500      0.9333000    
 H   -3.908000      -3.137100      -1.357000    
 H   -4.477200      -3.419600      0.2670000    
 H   -1.169400      -4.892900       1.265900    
 H   -2.462200      -5.873300      0.6628000    
 H   -3.946800      1.1200000E-02 -0.7941000    
 H   -1.048500       3.914900      0.4277000    
 H   0.9531000      -1.834200     -0.5937000    
 H   -5.263800      -5.044800      -1.503400    
 H   -4.470300      -5.877000     -0.1762000    
 H   -3.608600      -5.617300      -1.713500    
 H   -2.824400      -5.170700       3.010000    
 H   -4.132600      -4.547400       2.034400    
 H   -2.824500      -3.473300       2.589400    
 H   -4.953900       2.220100     -0.4042000    
 H    2.378500       1.538900      2.9899999E-02
 H    3.054000      -2.726700     -0.3511000    
 H    4.696400       1.890900      0.4244000    
 H    5.458600      -2.343700      2.1400001E-02
 H   -3.872900       6.117400       1.667200    
 H   -2.599200       4.967000       2.072800    
 H   -2.358500       6.122500      0.7203000    
 H    7.035200       1.978800      0.8303000    
 H    6.596300       1.637300     -0.8728000    
 H    9.017700       2.008600     -0.6856000    
 H    8.670000      0.3308000      -1.167700    
 H    9.141600      0.6791000      0.4908000    


%chk=000027293-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000027293

0 1
O -5.079935 4.849030 0.356032
O 6.615778 -0.171345 -0.041876
N -1.362217 -0.308910 -0.682979
N -2.503064 -3.874950 -0.001771
N 0.057403 1.429433 -0.140317
N 1.013503 -0.773402 -0.610299
C -1.826568 -1.674047 -0.960262
C -2.021150 -2.517508 0.330782
C -2.179344 0.810811 -0.453533
C -0.026068 0.124489 -0.468175
C -1.281050 1.882500 -0.124392
C -3.979801 -3.934466 -0.173304
C -1.918841 -4.953090 0.839700
C -3.576928 0.988219 -0.505917
C -1.789920 3.162501 0.158438
C -3.197284 3.360722 0.109676
C -4.463928 -5.221844 -0.864347
C -2.353430 -4.974020 2.330160
C -4.069183 2.275032 -0.220761
C 2.409085 -0.536703 -0.449212
C -3.820921 4.692625 0.398218
C 2.948268 0.724436 -0.095380
C 3.288095 -1.636096 -0.656763
C -2.914973 5.872188 0.747222
C 4.344933 0.879042 0.049029
C 4.675638 -1.480233 -0.513771
C 5.215517 -0.218460 -0.158611
C 7.226703 1.122223 0.318047
C 8.735482 0.898467 0.375858
H -2.777216 -1.605589 -1.517538
H -1.120685 -2.195505 -1.633824
H -1.049776 -2.597106 0.854661
H -2.705601 -1.964481 1.016680
H -4.274813 -3.070707 -0.799439
H -4.514774 -3.807939 0.800491
H -0.817604 -4.854012 0.782878
H -2.163355 -5.924250 0.372136
H -4.260922 0.169702 -0.754689
H -1.101991 3.974901 0.408785
H 0.762091 -1.721529 -0.891600
H -5.546487 -5.153543 -1.076050
H -4.306581 -6.116625 -0.236035
H -3.928286 -5.370412 -1.818609
H -1.832071 -5.788921 2.865624
H -3.439893 -5.144861 2.437592
H -2.104716 -4.023725 2.837700
H -5.143495 2.484481 -0.242452
H 2.268348 1.565114 0.060361
H 2.885023 -2.619489 -0.933437
H 4.734126 1.864175 0.322559
H 5.359002 -2.319629 -0.672799
H -3.538957 6.761677 0.922254
H -2.320453 5.661955 1.655783
H -2.203206 6.083678 -0.072325
H 6.831735 1.457694 1.299604
H 6.961105 1.881744 -0.446422
H 9.249259 1.839326 0.644883
H 9.116296 0.558438 -0.602273
H 8.986598 0.133893 1.130709


