%chk=000010075.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010075

0 1
 O   -1.333400     -4.9300000E-02  -1.261400    
 O   -2.499500       2.414100     -0.2254000    
 O   -2.412300      -2.673300     -0.5940000    
 O   -3.312300      0.4602000      0.7462000    
 N    3.783800      0.6812000     -0.4188000    
 C   0.8928000      0.7142000     -0.6673000    
 C    1.640800       1.526900      0.3951000    
 C    2.912700      0.7059000      0.7806000    
 C  -0.5389000       1.165800      -1.022700    
 C    1.789900      0.5563000      -1.913000    
 C   0.5561000     -0.6208000     -0.1071000    
 C    2.562100     -0.7119000       1.362700    
 C   0.7605000       1.907500       1.600500    
 C    3.185300      6.2000002E-03  -1.574800    
 C    1.323100      -1.346600      0.7847000    
 C  -0.6924000      -1.021700     -0.5328000    
 C   -1.211600       1.994800      4.8000000E-02
 C  -0.6294000       2.321500       1.211200    
 C    5.129500      0.1857000     -0.1491000    
 C   0.8288000      -2.592900       1.169400    
 C   -1.194700      -2.251900     -0.1736000    
 C  -0.4134000      -3.047700      0.6768000    
 C   -3.469800       1.536500      0.1843000    
 C   -2.841700      -3.967300     -0.1648000    
 C   -4.815900       2.106700     -0.1546000    
 H    1.959900       2.478300     -5.9000000E-02
 H    3.447200       1.265000       1.560400    
 H  -0.5434000       1.745400      -1.954300    
 H    1.907900       1.539500      -2.388800    
 H    1.323400     -9.7199999E-02  -2.661500    
 H    2.389000     -0.5892000       2.440200    
 H    3.404600      -1.403900       1.267100    
 H    1.241600       2.740200       2.128300    
 H   0.6804000       1.092200       2.327400    
 H    3.128700      -1.077100      -1.411400    
 H    3.823400      0.1504000      -2.455700    
 H   -1.187100       2.903000       1.940900    
 H    5.577900      0.7152000      0.6986000    
 H    5.780300      0.3736000      -1.010600    
 H    5.155400     -0.8883000      5.9799999E-02
 H    1.385100      -3.212300       1.867900    
 H  -0.7273000      -4.027400       1.024100    
 H   -3.827000      -4.145000     -0.6076000    
 H   -2.964500      -4.006700      0.9227000    
 H   -2.174800      -4.753500     -0.5342000    
 H   -4.891100       2.263900      -1.233600    
 H   -4.966900       3.045700      0.3838000    
 H   -5.595000       1.401000      0.1480000    


%chk=000010075-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000010075

0 1
O -1.379064 -0.353982 -1.203185
O -2.630076 2.138113 -0.347463
O -2.276852 -3.063916 -0.622462
O -3.567955 2.871907 1.684676
N 3.718027 0.773849 -0.434072
C 0.822830 0.580896 -0.619709
C 1.523279 1.409889 0.485446
C 2.873856 0.687614 0.794689
C -0.639972 0.980709 -0.974236
C 1.714710 0.584009 -1.896989
C 0.616663 -0.823022 -0.080947
C 2.682185 -0.775234 1.354639
C 0.611773 1.601828 1.717272
C 3.135349 0.067677 -1.600977
C 1.477141 -1.516175 0.781946
C -0.626779 -1.314446 -0.492854
C -1.333855 1.747763 0.122365
C -0.794097 2.033316 1.337878
C 5.138752 0.449893 -0.220664
C 1.077168 -2.826810 1.145434
C -1.031041 -2.625250 -0.151810
C -0.138972 -3.377245 0.665254
C -3.669030 2.639380 0.462060
C -2.688858 -4.417359 -0.247898
C -4.901570 2.836184 -0.392569
H 1.787264 2.405774 0.079270
H 3.406199 1.270775 1.572607
H -0.739114 1.499425 -1.942203
H 1.777857 1.624263 -2.272943
H 1.248470 -0.039070 -2.683716
H 2.571686 -0.721861 2.457063
H 3.618011 -1.343781 1.180835
H 1.052006 2.361127 2.392520
H 0.547695 0.664877 2.307696
H 3.107993 -1.039983 -1.450554
H 3.786780 0.255810 -2.475446
H -1.386282 2.574203 2.080065
H 5.529363 1.035606 0.631307
H 5.717187 0.729234 -1.120548
H 5.342276 -0.631663 -0.016003
H 1.700569 -3.425453 1.820265
H -0.410467 -4.394306 0.965713
H -3.675407 -4.554460 -0.714408
H -2.777267 -4.523989 0.851356
H -1.982552 -5.176943 -0.637450
H -5.228961 1.865349 -0.803710
H -4.672901 3.493059 -1.249291
H -5.706219 3.275321 0.214353


