%chk=000170555.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170555

1 1
 O    1.260900     -0.7135000     -3.2800000E-02
 O   -2.929300      -3.693500      0.2819000    
 N   0.8484000       1.517400     -0.1260000    
 N   -2.970200      -1.335300      2.8600000E-02
 C    2.214700       1.338900     -0.1149000    
 C    2.469400     -3.3000000E-02 -5.7399999E-02
 C    3.767900     -0.5655000     -3.1599998E-02
 C   0.3472000      0.3041000     -7.7699997E-02
 C   0.1459000       2.766000     -0.1796000    
 C    4.833100      0.3704000     -6.8000004E-02
 C    3.254500       2.264300     -0.1506000    
 C    4.563700       1.755500     -0.1262000    
 C    4.006600      -1.949600      2.7000001E-02
 C   -1.046700      6.8899997E-02 -7.1999997E-02
 C  -0.1285000       3.305500       1.211200    
 C    6.143300     -0.1307000     -4.4000000E-02
 C    5.319900      -2.412300      4.9699999E-02
 C    6.382500      -1.508100      1.4300000E-02
 C   -1.619900      -1.151600      1.2600000E-02
 C   -3.877700     -0.1909000     -5.9000000E-02
 C   -3.550100      -2.632200      0.1663000    
 C   -4.269800      0.2079000      -1.301200    
 C   -4.267400      0.3946000       1.107700    
 C   -5.063000      -2.698000      0.1251000    
 C   -5.135300       1.298500      -1.384900    
 C   -5.133100       1.485200       1.023900    
 C   -5.567000       1.937100     -0.2225000    
 H   0.7565000       3.492000     -0.7297000    
 H  -0.7785000       2.682600     -0.7589000    
 H    3.083800       3.334300     -0.1925000    
 H    5.389100       2.466100     -0.1530000    
 H    3.186900      -2.662200      5.4800000E-02
 H   -1.682900      0.9428000     -0.1199000    
 H   0.8026000       3.444400       1.769800    
 H  -0.6395000       4.271300       1.152000    
 H  -0.7604000       2.618500       1.782700    
 H    6.994200      0.5469000     -7.0299998E-02
 H    5.518500      -3.479300      9.4899997E-02
 H    7.404700      -1.876400      3.2299999E-02
 H   -1.014000      -2.049700      7.8000002E-02
 H   -3.934400     -0.2890000      -2.205400    
 H   -3.930100      4.3200001E-02   2.077200    
 H   -5.376500      -3.743000      0.2218000    
 H   -5.444200      -2.327800     -0.8293000    
 H   -5.501600      -2.147100      0.9602000    
 H   -5.473100       1.650300      -2.355300    
 H   -5.469100       1.982500       1.929000    
 H   -6.240900       2.786300     -0.2877000    


%chk=000170555-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170555

1 1
O 1.170810 -0.499640 -0.025191
O -2.435825 -3.557085 0.092207
N 0.950456 1.736802 -0.167870
N -2.990826 -1.280535 -0.011649
C 2.346102 1.464304 -0.132073
C 2.477189 0.072740 -0.050400
C 3.711359 -0.617820 -0.002923
C 0.262972 0.552551 -0.092136
C 0.351454 3.094868 -0.210146
C 4.880330 0.248070 -0.047325
C 3.486415 2.311927 -0.175101
C 4.732428 1.680533 -0.131965
C 3.859802 -2.036153 0.080983
C -1.138219 0.328519 -0.080084
C 0.170348 3.699631 1.195897
C 6.172570 -0.365982 -0.003731
C 5.141469 -2.592745 0.121183
C 6.300892 -1.755894 0.078787
C -1.652523 -0.958816 -0.026016
C -4.012796 -0.240059 -0.057410
C -3.350878 -2.705192 0.049963
C -4.486294 0.215156 -1.309640
C -4.509003 0.300662 1.151256
C -4.826434 -3.019974 0.055962
C -5.481832 1.217667 -1.348552
C -5.504801 1.302448 1.102131
C -5.992252 1.759487 -0.145165
H 1.017053 3.721583 -0.827809
H -0.611910 3.028216 -0.743464
H 3.402278 3.399851 -0.236433
H 5.641420 2.290493 -0.162049
H 2.971280 -2.673968 0.113316
H -1.799118 1.198038 -0.111498
H 1.133434 3.778073 1.728372
H -0.253097 4.714744 1.106124
H -0.518037 3.094781 1.810988
H 7.064087 0.269736 -0.035864
H 5.263023 -3.678458 0.185564
H 7.295014 -2.212311 0.111362
H -0.992347 -1.834158 0.010837
H -4.087516 -0.214623 -2.235192
H -4.127569 -0.063300 2.111693
H -4.947205 -4.111403 0.099412
H -5.326285 -2.632351 -0.849310
H -5.334147 -2.561493 0.922925
H -5.861266 1.568590 -2.313540
H -5.901996 1.719045 2.033272
H -6.768909 2.530246 -0.179097


