%chk=000059301.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059301

0 1
 O   -1.609200       1.325700     -0.4079000    
 N   -6.861100     -0.2406000      0.5356000    
 C    1.741100     -0.3605000     -0.6279000    
 C    3.141300      6.8599999E-02 -0.1862000    
 C   0.7006000      0.7048000     -0.2898000    
 C    4.176800      -1.014600     -0.4959000    
 C  -0.6889000      0.3036000     -0.7645000    
 C    5.566100     -0.5878000     -9.6299998E-02
 C    6.363600      8.1400000E-02  -1.012900    
 C    6.025100     -0.8706000       1.181800    
 C   -2.903400      0.9389000     -0.1748000    
 C    7.649200      0.4765000     -0.6433000    
 C    7.310700     -0.4752000       1.551300    
 C   -5.529200      0.1566000      0.2959000    
 C   -3.423900     -0.1620000     -0.8454000    
 C   -3.682100       1.652700      0.7288000    
 C    8.122700      0.1983000      0.6388000    
 C   -4.741400     -0.5544000     -0.6093000    
 C   -4.999600       1.260000      0.9650000    
 C   -7.466400      -1.361600     -0.1144000    
 C   -8.891900      -1.540000      0.3715000    
 H    1.739900     -0.5469000      -1.708700    
 H    1.473100      -1.303700     -0.1366000    
 H    3.413700       1.003100     -0.6930000    
 H    3.138100      0.2826000      0.8902000    
 H   0.6790000      0.8837000      0.7925000    
 H   0.9757000       1.663800     -0.7467000    
 H    3.914800      -1.946300      2.2000000E-02
 H    4.162100      -1.255500      -1.566800    
 H  -0.9409000     -0.6531000     -0.2885000    
 H  -0.6927000      0.1808000      -1.853800    
 H    6.003200      0.3046000      -2.013100    
 H    5.399600      -1.392800       1.900100    
 H    8.281400       1.001400      -1.353600    
 H    7.679400     -0.6912000       2.549800    
 H   -2.853500     -0.7240000      -1.578500    
 H   -3.273300       2.512500       1.251800    
 H    9.123600      0.5063000      0.9268000    
 H   -5.116100      -1.414400      -1.156200    
 H   -5.603000       1.822400       1.673000    
 H   -7.397400      0.3082000       1.198700    
 H   -6.911300      -2.281800      0.1018000    
 H   -7.485200      -1.215700      -1.200700    
 H   -9.359900      -2.397300     -0.1223000    
 H   -9.495200     -0.6512000      0.1572000    
 H   -8.921100      -1.710800       1.453000    


%chk=000059301-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000059301

0 1
O -1.564620 0.758379 0.593108
N -7.167826 0.011058 0.166497
C 1.882350 -0.636353 -0.246948
C 3.308329 -0.096485 -0.001108
C 0.788832 0.305952 0.305275
C 4.414446 -1.036139 -0.557282
C -0.622700 -0.221498 0.035719
C 5.813861 -0.479874 -0.337935
C 6.384505 0.429683 -1.266360
C 6.562132 -0.816800 0.819679
C -2.943903 0.488457 0.442819
C 7.662975 0.989334 -1.045647
C 7.841636 -0.260184 1.046196
C -5.777506 0.151448 0.249089
C -3.484662 -0.655599 -0.186935
C -3.820976 1.464935 0.978459
C 8.396914 0.646663 0.113923
C -4.886784 -0.822021 -0.282855
C -5.211252 1.300378 0.883960
C -7.836930 -1.123766 -0.468791
C -9.365386 -0.969266 -0.388227
H 1.731512 -0.783946 -1.337312
H 1.783501 -1.638859 0.220289
H 3.413415 0.902719 -0.469720
H 3.470845 0.051467 1.085396
H 0.918212 0.439441 1.396480
H 0.886644 1.308684 -0.153532
H 4.316306 -2.026447 -0.070499
H 4.232369 -1.191066 -1.639525
H -0.776411 -1.210414 0.519996
H -0.800254 -0.335758 -1.055797
H 5.822815 0.696422 -2.170839
H 6.139814 -1.522807 1.546126
H 8.087900 1.687110 -1.776519
H 8.405748 -0.535327 1.944940
H -2.834348 -1.428220 -0.608747
H -3.390828 2.346489 1.464429
H 9.389782 1.077198 0.286589
H -5.278738 -1.717263 -0.775464
H -5.874482 2.067370 1.304380
H -7.750060 0.751096 0.555250
H -7.534614 -2.073895 0.024387
H -7.528987 -1.207734 -1.534763
H -9.865871 -1.826805 -0.870008
H -9.698625 -0.048832 -0.902905
H -9.704978 -0.924426 0.663230


