%chk=000090348.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090348

0 1
 O   -1.151700       1.138900      -1.445900    
 O   -4.565300      -2.937700      0.3932000    
 O   -5.703800      -1.281300     -0.6609000    
 O    5.772900     -0.9040000      0.7242000    
 O    5.397600     -0.8345000      -1.437700    
 N  -0.2716000      0.9042000      0.7173000    
 N   -2.836200       2.969000      3.7099998E-02
 N    5.012100     -0.6953000     -0.2517000    
 C   -2.573900       1.587100      0.4445000    
 C   -3.727500      0.6821000     -1.6600000E-02
 C   -3.546500     -0.7928000      0.3577000    
 C   -1.259700       1.180900     -0.2226000    
 C    1.062800      0.5005000      0.4725000    
 C   -4.717900      -1.660600     -4.4399999E-02
 C    1.907800      0.2692000       1.545000    
 C    1.494600      0.3453000     -0.8341000    
 C    3.673700     -0.2895000     -6.2000002E-03
 C    3.222800     -0.1288000       1.303900    
 C    2.809500     -5.2700002E-02  -1.075200    
 H   -2.497700       1.547900       1.536500    
 H   -3.851900      0.7534000      -1.106100    
 H   -4.667900       1.044800      0.4201000    
 H   -2.654100      -1.198800     -0.1307000    
 H   -3.423700     -0.8759000       1.443500    
 H  -0.5151000      0.9940000       1.701000    
 H   -2.116400       3.580000      0.4220000    
 H   -3.718500       3.282300      0.4402000    
 H    1.566300      0.3916000       2.569100    
 H   0.8889000      0.5072000      -1.713000    
 H    3.867700     -0.3045000       2.161200    
 H    3.127300     -0.1689000      -2.108500    
 H   -5.328900      -3.502100      0.1470000    


%chk=000090348-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000090348

0 1
O -1.203210 1.310333 -1.397691
O -4.440674 -2.999500 0.410159
O -5.745109 -1.334788 -0.551133
O 5.806328 -1.023864 0.752258
O 5.503432 -0.738847 -1.492658
N -0.305094 0.870321 0.732599
N -3.040781 3.041110 0.239543
N 5.079576 -0.711987 -0.271773
C -2.668095 1.650680 0.552706
C -3.801438 0.705369 0.089893
C -3.542694 -0.770327 0.442798
C -1.334277 1.253368 -0.140084
C 1.024235 0.483836 0.429131
C -4.694920 -1.670255 0.035541
C 1.869746 0.129149 1.520142
C 1.529860 0.439947 -0.901876
C 3.682055 -0.300497 -0.029623
C 3.197262 -0.262864 1.297713
C 2.860576 0.046399 -1.124856
H -2.560097 1.568843 1.654958
H -3.922907 0.806923 -1.004886
H -4.739540 1.055548 0.553584
H -2.631237 -1.156628 -0.053894
H -3.380935 -0.909132 1.530295
H -0.547066 0.868492 1.727408
H -2.404208 3.748994 0.622124
H -3.204061 3.183610 -0.764477
H 1.481722 0.161361 2.545678
H 0.876187 0.712515 -1.731599
H 3.861394 -0.538065 2.120733
H 3.273376 0.003715 -2.136195
H -5.203707 -3.572757 0.125883


