%chk=000032509.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032509

0 1
 O  -0.5687000      0.6358000     -0.1403000    
 O   -1.485100      0.9153000       1.950800    
 N    3.109800      0.2916000     -0.1083000    
 C   -2.941300      0.8797000     -1.4500000E-02
 C   -3.159000     -0.4396000     -0.8128000    
 C    4.103700      0.6153000      -1.141400    
 C    3.362100      -1.033600      0.4748000    
 C    5.521500      0.5985000     -0.5678000    
 C    4.755600      -1.104600       1.101000    
 C    5.837200     -0.7396000      9.0499997E-02
 C   -2.913500       2.056500      -1.031600    
 C    1.757200      0.3582000     -0.6608000    
 C   -3.139300      -1.726800      2.3900000E-02
 C   -4.087100       1.081600      0.9956000    
 C   -1.601900      0.8172000      0.7349000    
 C   0.7344000      0.5594000      0.4460000    
 C   -3.288300      -2.962900     -0.8661000    
 C   -2.694000       3.440400     -0.4292000    
 C   -3.303400      -4.242300     -4.4700000E-02
 H   -4.118700     -0.3818000      -1.343900    
 H   -2.387800     -0.5249000      -1.590300    
 H    4.036200     -8.8699996E-02  -1.981400    
 H    3.914300       1.619300      -1.540600    
 H    2.641000      -1.259400       1.267100    
 H    3.264500      -1.820000     -0.2856000    
 H    6.246000      0.7980000      -1.365500    
 H    5.628900       1.403400      0.1705000    
 H    4.809200     -0.4201000       1.957200    
 H    4.937300      -2.114000       1.487000    
 H    6.814100     -0.6952000      0.5843000    
 H    5.898900      -1.520200     -0.6777000    
 H   -3.857700       2.074300      -1.591600    
 H   -2.123600       1.886500      -1.774700    
 H    1.661200       1.215500      -1.341300    
 H    1.510000     -0.5226000      -1.268300    
 H   -2.201600      -1.801000      0.5860000    
 H   -3.957200      -1.715300      0.7521000    
 H   -4.132200      0.2693000       1.728400    
 H   -3.960900       2.001600       1.576100    
 H   -5.056400       1.132800      0.4879000    
 H   0.9391000       1.491500      0.9869000    
 H   0.7395000     -0.2745000       1.155300    
 H   -4.217800      -2.896600      -1.443400    
 H   -2.461600      -3.006200      -1.584700    
 H   -1.768100       3.486300      0.1516000    
 H   -2.620800       4.184500      -1.229500    
 H   -3.526200       3.737600      0.2149000    
 H   -4.139800      -4.245500      0.6614000    
 H   -2.374000      -4.355100      0.5226000    
 H   -3.409000      -5.112400     -0.7002000    


%chk=000032509-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000032509

0 1
O -0.587025 0.702073 -0.139585
O -1.513089 0.934768 1.977002
N 3.130422 0.242862 -0.136708
C -3.004459 0.900521 -0.027394
C -3.185593 -0.450962 -0.802972
C 4.176942 0.713951 -1.080544
C 3.395207 -1.148447 0.315270
C 5.572531 0.665020 -0.425934
C 4.765489 -1.256558 1.013621
C 5.892648 -0.760484 0.079463
C -2.955725 2.055376 -1.086423
C 1.755913 0.418732 -0.662693
C -3.176055 -1.733630 0.058433
C -4.155040 1.119663 0.982497
C -1.669991 0.856357 0.736635
C 0.763831 0.628839 0.487949
C -3.299694 -3.014468 -0.799373
C -2.674961 3.464889 -0.523767
C -3.305938 -4.305595 0.047146
H -4.147634 -0.388818 -1.352985
H -2.382736 -0.523709 -1.562302
H 4.191044 0.092039 -2.015762
H 3.934633 1.751335 -1.377710
H 2.594041 -1.458114 1.011026
H 3.369306 -1.858037 -0.555418
H 6.332734 1.001694 -1.156997
H 5.588845 1.371045 0.426815
H 4.746946 -0.640767 1.933356
H 4.941497 -2.307095 1.315325
H 6.866995 -0.776645 0.603292
H 5.979682 -1.447609 -0.788094
H -3.930377 2.055938 -1.615468
H -2.181100 1.803104 -1.834544
H 1.732921 1.312072 -1.313213
H 1.421008 -0.446219 -1.286010
H -2.237695 -1.784824 0.648444
H -4.005773 -1.711578 0.792268
H -4.183251 0.320116 1.740613
H -4.038939 2.071199 1.527413
H -5.121911 1.134700 0.445988
H 0.968818 1.566744 1.032069
H 0.771792 -0.201340 1.216506
H -4.229640 -2.961334 -1.402265
H -2.461162 -3.048905 -1.524749
H -1.705199 3.501879 0.006606
H -2.633010 4.203663 -1.345038
H -3.458669 3.795657 0.180515
H -4.153097 -4.308275 0.758745
H -2.374371 -4.397040 0.637060
H -3.394409 -5.206584 -0.587507


