%chk=000057770.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057770

0 1
 O   -2.028400       2.714800      1.6300000E-02
 O   -3.740900      -1.740800     -4.7600001E-02
 O    1.292200      -2.129100     -0.4135000    
 N    3.317700     -0.6372000      0.7321000    
 N    2.001200     -0.2099000      0.6810000    
 C    4.183200      0.3299000      5.8499999E-02
 C    3.816400      0.4285000      -1.419500    
 C    5.640700     -8.3899997E-02  0.2350000    
 C  -0.3269000     -0.4970000      4.9400002E-02
 C    1.059700      -1.030600      8.5299999E-02
 C   -1.381300      -1.385500      1.7600000E-02
 C  -0.5147000      0.8693000      4.9699999E-02
 C   -1.816200       1.370200      1.6300000E-02
 C   -2.682800     -0.8848000     -1.5500000E-02
 C   -2.900400      0.4930000     -1.6200000E-02
 C  -0.8752000       3.554000      5.1399998E-02
 C   -5.044100      -1.161000     -8.0499999E-02
 H    4.061200       1.319600      0.5184000    
 H    3.571200     -0.6967000       1.717900    
 H    4.515100       1.090900      -1.942800    
 H    3.859700     -0.5503000      -1.910900    
 H    2.813500      0.8421000      -1.569700    
 H    5.911700     -0.1302000       1.295700    
 H    6.309200      0.6384000     -0.2459000    
 H    5.835600      -1.067400     -0.2073000    
 H    1.775900      0.6562000       1.159500    
 H   -1.222400      -2.460100      2.3000000E-02
 H   0.3454000       1.525300      3.0900000E-02
 H   -3.887300      0.9434000     -4.1099999E-02
 H   -1.230700       4.589700      5.7799999E-02
 H  -0.2624000       3.434200     -0.8485000    
 H  -0.2985000       3.410400      0.9716000    
 H   -5.250300     -0.5822000      0.8262000    
 H   -5.764100      -1.985700     -0.1031000    
 H   -5.201200     -0.5750000     -0.9924000    


%chk=000057770-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000057770

0 1
O -2.178736 2.817958 0.012774
O -3.773784 -1.766412 0.034309
O 1.282461 -2.181631 -0.620835
N 3.379393 -0.695894 0.626474
N 2.021430 -0.331323 0.625901
C 4.320198 0.309518 0.064634
C 4.071230 0.480537 -1.446028
C 5.751429 -0.179870 0.360655
C -0.333367 -0.463034 -0.006036
C 1.049467 -1.081007 -0.052015
C -1.432183 -1.340162 -0.007079
C -0.528051 0.948546 0.001833
C -1.847975 1.452299 0.023008
C -2.748089 -0.813159 0.025260
C -2.965756 0.581225 0.046067
C -1.078365 3.782468 -0.032524
C -5.155113 -1.277084 0.046141
H 4.179554 1.305522 0.560328
H 3.677049 -1.100875 1.523878
H 4.740741 1.254446 -1.864499
H 4.249816 -0.476076 -1.966654
H 3.027135 0.782170 -1.644236
H 5.938031 -0.267298 1.448770
H 6.491355 0.527115 -0.052769
H 5.915177 -1.169566 -0.101825
H 1.713242 0.485704 1.171306
H -1.273240 -2.420791 -0.044913
H 0.328820 1.624066 -0.072843
H -3.963704 1.025990 0.063429
H -1.562210 4.770268 -0.032906
H -0.475571 3.663271 -0.953822
H -0.423411 3.689823 0.856170
H -5.362141 -0.680207 0.955649
H -5.779063 -2.182686 0.046005
H -5.373972 -0.671352 -0.854508


