%chk=000099645.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099645

0 1
 O    4.533800      -1.567200     -0.5807000    
 O   -4.538400       1.557800      0.6131000    
 N    3.054700      0.2098000     -0.2913000    
 N   -3.054300     -0.2088000      0.2882000    
 N    5.375100      0.4697000      0.1277000    
 N   -5.374700     -0.4687000     -0.1301000    
 C   0.6137000      0.3343000     -0.1157000    
 C  -0.6132000     -0.3333000      0.1120000    
 C    1.811700     -0.3976000     -7.4600004E-02
 C   -1.811200      0.3984000      7.0900001E-02
 C   0.6067000       1.714000     -0.3776000    
 C  -0.6061000      -1.713100      0.3738000    
 C    1.800100      -1.768000      0.1868000    
 C   -1.799600       1.768800     -0.1911000    
 C  -0.5930000       2.425300     -0.4147000    
 C   0.5936000      -2.424500      0.4106000    
 C    4.328400     -0.3890000     -0.2812000    
 C   -4.327900      0.3900000      0.2783000    
 C    6.757300      1.7200001E-02  0.2204000    
 C    5.139300       1.867300      0.4841000    
 C   -6.763100     -2.8500000E-02 -0.1806000    
 C   -5.132900      -1.853900     -0.5284000    
 H    1.508100       2.288000     -0.5650000    
 H   -1.507700      -2.287000      0.5613000    
 H    2.686700      -2.382100      0.2687000    
 H   -2.688500       2.380400     -0.2713000    
 H  -0.5849000       3.490700     -0.6270000    
 H   0.5853000      -3.489800      0.6229000    
 H    3.050900       1.211700     -0.4275000    
 H   -3.051600      -1.211100      0.4227000    
 H    6.853900      -1.026200     -8.9699998E-02
 H    7.091100      0.1131000       1.257600    
 H    7.377200      0.6423000     -0.4285000    
 H    4.957400       2.435600     -0.4326000    
 H    6.011400       2.280400      0.9996000    
 H    4.274000       1.949800       1.147900    
 H   -7.117000     -9.4899997E-02  -1.213400    
 H   -6.864100       1.003300      0.1647000    
 H   -7.363300     -0.6809000      0.4602000    
 H   -4.988900      -2.455100      0.3739000    
 H   -4.246100      -1.922900      -1.164600    
 H   -5.988900      -2.240500      -1.089500    


%chk=000099645-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099645

0 1
O 4.605014 -1.654978 0.161155
O -4.604848 1.655193 -0.173229
N 3.097174 0.167242 0.106856
N -3.097459 -0.167057 -0.108893
N 5.423462 0.538846 0.188591
N -5.423868 -0.538590 -0.185642
C 0.648262 0.325247 0.023011
C -0.648365 -0.325035 -0.030006
C 1.847314 -0.501293 0.057910
C -1.847473 0.501490 -0.063479
C 0.701240 1.759106 0.039008
C -0.701276 -1.758879 -0.047835
C 1.748704 -1.902022 0.041185
C -1.748804 1.902231 -0.048305
C -0.469693 2.517397 0.002961
C 0.469672 -2.517168 -0.012285
C 4.384126 -0.403016 0.152596
C -4.384301 0.403254 -0.156851
C 6.808505 0.044798 0.241322
C 5.204463 1.992305 0.175855
C -6.808783 -0.044669 -0.242640
C -5.205043 -1.991960 -0.163159
H 1.652637 2.302399 0.081016
H -1.652567 -2.302121 -0.092746
H 2.661820 -2.497750 0.069174
H -2.661911 2.497969 -0.076356
H -0.411899 3.611243 0.015397
H 0.411956 -3.610992 -0.026827
H 3.044685 1.183514 0.109234
H -3.045187 -1.183337 -0.105940
H 6.776512 -1.055124 0.247481
H 7.320194 0.396022 1.158058
H 7.384684 0.382815 -0.641597
H 4.688000 2.332352 -0.745799
H 6.181571 2.499640 0.203154
H 4.632971 2.340801 1.061364
H -7.319693 -0.401119 -1.157807
H -6.776615 1.055196 -0.255183
H -7.385784 -0.377487 0.641695
H -4.685146 -2.325170 0.759013
H -4.636930 -2.347172 -1.048228
H -6.182317 -2.499322 -0.182925


