%chk=000035820.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035820

1 1
 O    4.489400       2.458300      0.3001000    
 O    5.033200      -2.254200     -0.3579000    
 O    6.099500      0.2046000      0.3397000    
 N   -3.866500     -0.9238000      0.4030000    
 N  -0.1880000     -0.4714000     -9.2000002E-03
 N   -5.748600      -1.781900     -0.2321000    
 C   -2.473300     -0.8260000      0.7927000    
 C   -1.581100     -0.5856000     -0.4192000    
 C   -4.757900      0.1261000      0.3199000    
 C   -5.973000     -0.4279000     -9.0099998E-02
 C   -4.476900      -2.065100      6.7599997E-02
 C   0.6727000     -0.2125000      -1.155400    
 C    2.120100     -0.1012000     -0.7564000    
 C   -4.601400       1.485200      0.5654000    
 C   -7.116100      0.3386000     -0.2833000    
 C    2.913900      -1.239400     -0.7410000    
 C    2.639700       1.137900     -0.4088000    
 C   -5.746400       2.271700      0.3749000    
 C   -6.973900       1.712100     -3.9400000E-02
 C    3.980600       1.240700     -3.8500000E-02
 C    4.254800      -1.136500     -0.3706000    
 C    4.788100      0.1036000     -1.9300001E-02
 C    5.048700       3.242300     -0.7518000    
 C    5.086400      -2.993200      0.8609000    
 C    6.375800      0.6977000       1.648700    
 H   -2.194700      -1.762100       1.293100    
 H   -2.361900     -2.6600000E-02   1.534500    
 H   -1.905700      0.3281000     -0.9320000    
 H   -1.703800      -1.416500      -1.124500    
 H   -4.029900      -3.045400      3.9600000E-02
 H  -9.6500002E-02  0.2876000      0.6661000    
 H   0.3695000      0.7122000      -1.664400    
 H   0.5705000      -1.015400      -1.897400    
 H   -6.444400      -2.463700     -0.5219000    
 H   -3.657300       1.910900      0.8805000    
 H   -8.051600     -0.1030000     -0.6014000    
 H    2.501500      -2.207600      -1.013200    
 H    2.012700       2.025700     -0.4204000    
 H   -5.688000       3.343700      0.5503000    
 H   -7.833100       2.365600     -0.1732000    
 H    4.284500       3.483800      -1.497400    
 H    5.424600       4.174400     -0.3214000    
 H    5.882500       2.714400      -1.225400    
 H    5.486400      -2.375300       1.670900    
 H    4.091800      -3.364200       1.127700    
 H    5.750900      -3.849000      0.7138000    
 H    5.555500      0.5006000       2.347800    
 H    7.268900      0.1859000       2.019200    
 H    6.592600       1.768700       1.608000    


%chk=000035820-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000035820

1 1
O 5.199470 2.336349 -0.691434
O 3.909841 -2.035090 1.306220
O 5.947782 0.054254 0.912561
N -3.969504 -1.075747 -0.169277
N -0.412503 0.210866 -0.214763
N -5.846137 -1.748669 -1.153167
C -2.526100 -0.951071 0.167404
C -1.815086 0.192120 -0.618036
C -5.006810 -0.225820 0.298089
C -6.211976 -0.660840 -0.330605
C -4.505549 -1.971664 -1.037621
C 0.601803 0.565842 -1.241566
C 2.014256 0.423883 -0.687533
C -4.996418 0.850280 1.209607
C -7.451192 -0.037104 -0.082116
C 2.384615 -0.727626 0.040954
C 2.978109 1.426357 -0.943822
C -6.234382 1.473243 1.460581
C -7.437362 1.039418 0.826273
C 4.292874 1.282159 -0.453635
C 3.695971 -0.875506 0.554231
C 4.657703 0.156289 0.341714
C 6.435897 1.966124 -1.425034
C 5.248340 -2.664075 1.340448
C 6.223115 1.063494 1.968844
H -2.022596 -1.905388 -0.056097
H -2.446531 -0.778360 1.254789
H -2.360773 1.152136 -0.459125
H -1.868802 -0.029122 -1.700632
H -3.951221 -2.751510 -1.552412
H -0.232271 0.671799 0.684509
H 0.468645 1.599664 -1.634316
H 0.455544 -0.123477 -2.098557
H -6.477199 -2.296103 -1.740272
H -4.081670 1.189976 1.702584
H -8.377735 -0.364957 -0.561513
H 1.662165 -1.525010 0.236843
H 2.738302 2.323841 -1.523301
H -6.277250 2.312652 2.160773
H -8.373722 1.557105 1.054105
H 6.178847 1.628318 -2.446325
H 7.029432 2.891024 -1.474427
H 6.990679 1.174238 -0.892358
H 5.700440 -2.682303 0.332909
H 5.922564 -2.132103 2.028677
H 5.059142 -3.689686 1.693906
H 5.529508 0.922362 2.818446
H 7.258629 0.874853 2.289625
H 6.123918 2.085483 1.562653


