%chk=000148063.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148063

0 1
 O   -2.613400      -1.254400      -3.029400    
 O   -1.966400      0.9100000      -1.357500    
 N   -3.211000      -1.783200      0.5824000    
 N    4.141500       1.115500      0.3532000    
 C   -2.491000      -2.581300       1.580100    
 C   -2.560500      -1.877800     -0.7134000    
 C   -1.055300      -2.058800       1.709900    
 C   -3.219500      -2.458000       2.922700    
 C   -2.479900      -4.043000       1.120200    
 C   -3.282700      -1.053000      -1.781400    
 C   -3.306800      0.4430000      -1.475100    
 C   -1.757400       1.976300     -0.5243000    
 C  -0.5488000       2.135800      0.1478000    
 C   -2.782300       2.904300     -0.3602000    
 C    3.796700     -0.1924000     -5.7999998E-02
 C  -0.3636000       3.231700      0.9906000    
 C   -2.596900       4.000400      0.4825000    
 C    2.468600     -0.5467000     -0.3007000    
 C   -1.387700       4.164000       1.157900    
 C   0.5140000       1.190900     -1.0400000E-02
 C    4.812000      -1.135200     -0.2200000    
 C    2.158400      -1.845800     -0.7059000    
 C    1.406000      0.3979000     -0.1430000    
 C    4.812300       1.330800       1.617900    
 C    3.839500       2.250800     -0.4929000    
 C    4.500500      -2.433100     -0.6251000    
 C    3.173800      -2.788400     -0.8680000    
 H   -3.239700     -0.8115000      0.8882000    
 H   -1.516600      -1.549700     -0.7000000    
 H   -2.555700      -2.905600      -1.091200    
 H   -1.028200     -0.9699000       1.831700    
 H  -0.5767000      -2.487700       2.599200    
 H  -0.4162000      -2.335300      0.8680000    
 H   -3.247200      -1.417900       3.268400    
 H   -2.722200      -3.050200       3.699400    
 H   -4.254200      -2.813100       2.849000    
 H   -2.156600      -4.693900       1.942500    
 H   -3.479000      -4.383800      0.8233000    
 H   -1.784900      -4.239700      0.2971000    
 H   -4.313000      -1.408500      -1.903300    
 H   -3.898700      0.6124000     -0.5679000    
 H   -3.775000      0.9725000      -2.313800    
 H   -2.665700      -2.202000      -3.241600    
 H   -3.727200       2.838600     -0.8908000    
 H   0.5734000       3.374300       1.523900    
 H   -3.390900       4.730900      0.6069000    
 H   -1.242800       5.018400       1.812500    
 H    5.852200     -0.8746000     -4.1999999E-02
 H    1.132100      -2.138400     -0.9119000    
 H    4.351900      0.7341000       2.413000    
 H    5.871400       1.063000       1.546100    
 H    4.753200       2.381600       1.921700    
 H    3.030700       2.850000     -6.3299999E-02
 H    4.720300       2.896700     -0.5813000    
 H    3.558600       1.953700      -1.509600    
 H    5.291200      -3.166600     -0.7534000    
 H    2.931600      -3.798100      -1.186300    


%chk=000148063-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000148063

0 1
O -3.101605 -1.040087 -3.092969
O -2.143114 0.791094 -0.819017
N -2.673927 -1.869122 0.578761
N 4.202852 1.301508 0.666534
C -2.327418 -3.033450 1.457220
C -2.438064 -1.979635 -0.875312
C -0.859776 -3.517961 1.258920
C -2.516741 -2.544495 2.914259
C -3.312634 -4.197028 1.180065
C -3.444116 -1.100417 -1.658656
C -3.505781 0.347001 -1.171408
C -1.970874 2.118512 -0.418056
C -0.630889 2.482582 -0.052810
C -3.015271 3.070069 -0.356432
C 3.781104 0.022868 0.260256
C -0.390587 3.822427 0.366343
C -2.743026 4.392314 0.062857
C 2.427724 -0.239856 -0.186483
C -1.430954 4.771782 0.425144
C 0.430541 1.530005 -0.108636
C 4.686498 -1.081153 0.323707
C 2.082244 -1.557853 -0.612770
C 1.387256 0.739692 -0.147781
C 5.410499 1.446565 1.488610
C 3.794639 2.534107 -0.030996
C 4.304777 -2.376533 -0.072455
C 2.999250 -2.622256 -0.561848
H -2.233696 -1.006576 0.931236
H -1.414096 -1.678389 -1.186983
H -2.588814 -3.030739 -1.188293
H -0.144057 -2.701633 1.469603
H -0.626859 -4.363298 1.933294
H -0.689572 -3.860567 0.220871
H -1.827768 -1.708436 3.143378
H -2.308478 -3.359875 3.629714
H -3.552341 -2.192810 3.068609
H -3.129983 -5.030560 1.882673
H -4.352943 -3.847872 1.302852
H -3.200346 -4.598465 0.155523
H -4.463179 -1.526541 -1.528324
H -4.150175 0.412802 -0.273839
H -3.916106 0.977084 -1.983353
H -2.911967 -1.955367 -3.421061
H -4.036870 2.794257 -0.631067
H 0.630973 4.101047 0.646451
H -3.559614 5.121415 0.105062
H -1.221557 5.795948 0.750356
H 5.715373 -0.912711 0.654829
H 1.057121 -1.725129 -0.961468
H 5.448702 0.662429 2.263715
H 6.353400 1.405722 0.896848
H 5.376901 2.425963 1.998536
H 3.307347 3.251061 0.658821
H 4.684684 3.028574 -0.474958
H 3.088985 2.308641 -0.841673
H 5.035843 -3.191503 -0.018753
H 2.702685 -3.625151 -0.885245


