%chk=000118665.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000118665

0 1
 O   -3.322900      0.6032000       1.288800    
 O    3.268500      0.4171000      -1.316300    
 O   -5.690500      -1.811300     -0.1448000    
 O    5.692100      -1.774000      0.3647000    
 N   -4.224100      0.4344000     -0.8432000    
 N    4.262300      0.5614000      0.7777000    
 N   -5.518000      0.4928000     -0.3907000    
 N    5.536100      0.5423000      0.2693000    
 C  -0.6763000      0.4866000      0.3771000    
 C   0.6731000      0.4440000     -0.3447000    
 C   -1.836900      0.4194000     -0.6131000    
 C    1.854900      0.5182000      0.6211000    
 C   -3.188900      0.4970000      7.2400004E-02
 C    3.191800      0.4946000     -9.1700003E-02
 C   -6.167300     -0.6815000     -6.7000002E-02
 C    6.168500     -0.6728000      9.8899998E-02
 C   -7.563200     -0.4441000      0.4428000    
 C    7.540900     -0.5272000     -0.5013000    
 H  -0.7466000       1.408000      0.9685000    
 H  -0.7438000     -0.3493000       1.084300    
 H   0.7308000       1.277200      -1.056600    
 H   0.7413000     -0.4780000     -0.9358000    
 H   -1.768800       1.248900      -1.327200    
 H   -1.792100     -0.5182000      -1.179900    
 H    1.798500       1.440900       1.210700    
 H    1.822400     -0.3284000       1.317100    
 H   -4.091300      0.3516000      -1.845600    
 H    4.170200      0.6281000       1.785900    
 H   -5.933700       1.414600     -0.3090000    
 H    5.949400       1.438100      3.3100002E-02
 H   -8.018400      0.4218000     -4.6300001E-02
 H   -8.180800      -1.322400      0.2349000    
 H   -7.526900     -0.2718000       1.521800    
 H    8.021900      0.3948000     -0.1621000    
 H    7.456400     -0.5110000      -1.591100    
 H    8.163100      -1.373500     -0.1968000    


%chk=000118665-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000118665

0 1
O -3.433401 -1.384132 0.889950
O 3.434970 -1.384978 -0.926930
O -6.279480 1.801473 -1.303255
O 6.283075 1.787253 1.282498
N -4.217111 0.290732 -0.475223
N 4.221400 0.276380 0.452938
N -5.497440 0.135311 0.074620
N 5.500805 0.125148 -0.100068
C -0.689032 -0.332810 0.329335
C 0.692654 -0.330337 -0.356367
C -1.846701 -0.333680 -0.697226
C 1.850236 -0.347287 0.670388
C -3.200062 -0.526584 -0.025502
C 3.203069 -0.535512 -0.003544
C -6.517090 0.940524 -0.393382
C 6.519984 0.930719 0.368324
C -7.876176 0.717215 0.241233
C 7.877734 0.712888 -0.271167
H -0.787290 0.548648 0.994343
H -0.796659 -1.227461 0.971330
H 0.793399 0.559270 -1.010013
H 0.797970 -1.217087 -1.009635
H -1.837073 0.594172 -1.301486
H -1.698703 -1.178009 -1.400580
H 1.842733 0.572932 1.286261
H 1.699818 -1.200043 1.362889
H -4.173138 1.016054 -1.199364
H 4.177772 0.997983 1.180771
H -5.542940 -0.594091 0.793863
H 5.544904 -0.598126 -0.825584
H -7.868117 -0.070072 1.014061
H -8.224643 1.660820 0.694996
H -8.602280 0.441066 -0.542640
H 7.870563 -0.076115 -1.042246
H 8.608018 0.442041 0.510613
H 8.219932 1.657195 -0.728300


