%chk=000135668.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135668

0 1
 O   -3.620300       3.120000     -0.5972000    
 O   0.9611000       1.852300       2.152200    
 N    1.757100       2.004900     -2.0300001E-02
 N    3.989300      0.3393000     -0.7465000    
 N   1.4000000E-02 -0.9007000      0.4931000    
 C  -0.8864000      6.3600004E-02  0.2212000    
 C   -2.169100     -0.2352000     -0.2687000    
 C  -0.5582000       1.401400      0.4240000    
 C    3.115900       2.357400      0.3233000    
 C    3.982600       1.117300      0.4857000    
 C   -1.561700      -2.586000     -0.1897000    
 C   -2.492600      -1.580800     -0.4702000    
 C  -0.3029000      -2.195300      0.2972000    
 C   -3.085000      0.7956000     -0.5423000    
 C   0.7588000       1.773200      0.9298000    
 C   -1.466000       2.428200      0.1533000    
 C   -2.732100       2.125200     -0.3310000    
 C   -1.859900      -3.946100     -0.3830000    
 C   0.6284000      -3.191500      0.5784000    
 C    4.790800     -0.8755000     -0.5857000    
 C    4.500800       1.140300      -1.860400    
 C  -0.9113000      -4.922600     -9.4200000E-02
 C   0.3353000      -4.544100      0.3874000    
 C   -3.188700       4.459000     -0.3563000    
 H    3.489900       3.063200     -0.4236000    
 H    3.100800       2.900700       1.275700    
 H    4.996900       1.417700      0.7782000    
 H    3.576800      0.5059000       1.301900    
 H   -3.478400      -1.848200     -0.8490000    
 H   -4.077500      0.5612000     -0.9219000    
 H   -1.129800       3.443500      0.3394000    
 H    1.527400       1.910300      -1.005600    
 H   -2.833500      -4.251700     -0.7598000    
 H    1.612700      -2.919900      0.9561000    
 H    4.392600      -1.493700      0.2267000    
 H    5.841300     -0.6521000     -0.3674000    
 H    4.748400      -1.488400      -1.493000    
 H    5.465400       1.608000      -1.631200    
 H    3.791900       1.911500      -2.175900    
 H    4.641400      0.5104000      -2.747400    
 H   -1.144200      -5.972200     -0.2446000    
 H    1.082900      -5.298100      0.6156000    
 H   -2.345600       4.731700      -1.000000    
 H   -2.973000       4.627500      0.7042000    
 H   -4.020600       5.119400     -0.6223000    


%chk=000135668-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000135668

0 1
O -4.179045 3.113354 0.104661
O 0.851083 3.763829 0.159625
N 1.815115 1.646004 -0.013937
N 4.105792 -0.202074 -0.208457
N 0.162986 -0.451393 -0.230871
C -0.888547 0.420954 -0.145575
C -2.277596 -0.043816 -0.189011
C -0.636328 1.844393 -0.010289
C 3.189520 2.145814 0.029930
C 4.149316 1.067957 0.563155
C -1.419237 -2.343757 -0.407042
C -2.502766 -1.439551 -0.319785
C -0.068803 -1.792826 -0.358517
C -3.349281 0.897171 -0.100714
C 0.740162 2.492222 0.050429
C -1.717112 2.723685 0.069514
C -3.072877 2.260258 0.025703
C -1.581505 -3.768453 -0.541024
C 1.060070 -2.679157 -0.446571
C 4.835386 -1.281591 0.492460
C 4.567133 -0.049836 -1.605998
C -0.469139 -4.600416 -0.622901
C 0.861672 -4.050938 -0.575506
C -3.931614 4.555799 0.235530
H 3.508572 2.496472 -0.973746
H 3.224951 3.035275 0.685938
H 5.183261 1.501542 0.582880
H 3.870133 0.830093 1.606884
H -3.532145 -1.817608 -0.353316
H -4.390442 0.559992 -0.131860
H -1.463631 3.784919 0.167439
H 1.609922 0.625527 -0.124905
H -2.595080 -4.185662 -0.577242
H 2.056253 -2.224147 -0.407408
H 4.404952 -1.430580 1.498683
H 5.928764 -1.071676 0.610506
H 4.733705 -2.227730 -0.069844
H 5.628401 0.298995 -1.680195
H 3.928819 0.669861 -2.144695
H 4.487877 -1.021406 -2.125380
H -0.598516 -5.683526 -0.724423
H 1.721256 -4.727217 -0.642249
H -3.375976 4.949414 -0.636221
H -3.377525 4.786400 1.164769
H -4.932239 5.010031 0.275775


