%chk=000149897.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149897

0 1
 O    1.396100       3.873800     -0.6803000    
 O   -1.141400      -1.817600     -0.1164000    
 O   -5.190000       1.667200      4.8400000E-02
 N    4.929700      -1.859000     -1.3400000E-02
 N    2.129600       1.916200      0.3231000    
 C    4.421300       1.017000      0.2552000    
 C    4.186900      0.2376000      -1.044500    
 C    3.531800       2.263800      0.3634000    
 C    5.129900     -0.9610000      -1.144600    
 C    5.830300      -3.009800     -0.1032000    
 C    3.537600      -2.307600      4.8799999E-02
 C    3.833300       3.034900       1.644600    
 C    1.139500       2.754200     -0.2030000    
 C  -0.2313000       2.271300     -0.1489000    
 C    7.282100      -2.566800     -0.1688000    
 C    3.299200      -3.191800       1.261100    
 C   -1.807100      0.4350000     -8.7600000E-02
 C   -2.865000       1.345400     -4.3299999E-02
 C  -0.4876000      0.8999000     -0.1407000    
 C   -1.286900       3.179800     -0.1043000    
 C   -3.465800      -1.495600     -2.3399999E-02
 C   -4.523800     -0.5851000      2.0400001E-02
 C   -2.068800      -1.018700     -7.8900002E-02
 C   -2.603400       2.720800     -5.1600002E-02
 C   -4.262000      0.8686000      1.1900000E-02
 C   -3.727400      -2.870900     -1.4900000E-02
 C   -5.843300      -1.050100      7.2800003E-02
 C   -5.044000      -3.329900      3.7300002E-02
 C   -6.099600      -2.421500      8.0799997E-02
 H    4.230600      0.3764000       1.124800    
 H    5.474500       1.321200      0.3095000    
 H    3.137200     -3.6200002E-02  -1.186600    
 H    4.414500      0.9059000      -1.886400    
 H    3.743900       2.922800     -0.4876000    
 H    4.963000      -1.473000      -2.101200    
 H    6.146700     -0.5546000      -1.163500    
 H    5.751500      -3.631800      0.7942000    
 H    5.599900      -3.644000     -0.9685000    
 H    2.848100      -1.470200      0.1854000    
 H    3.236200      -2.838000     -0.8632000    
 H    3.226100       3.944500       1.707700    
 H    4.886800       3.330800       1.684600    
 H    3.613800       2.431200       2.532400    
 H    1.861800       1.063800      0.8042000    
 H    7.553600      -2.164300      -1.149600    
 H    7.516400      -1.823400      0.6009000    
 H    7.935600      -3.429700      3.5000001E-03
 H    3.718800      -4.194900       1.137300    
 H    3.704700      -2.745400       2.175500    
 H    2.221700      -3.322900       1.413200    
 H   0.3224000      0.1790000     -0.2079000    
 H   -1.106200       4.251700     -0.1050000    
 H   -3.409000       3.449300     -1.6500000E-02
 H   -2.922000      -3.599600     -4.8300002E-02
 H   -6.683800     -0.3622000      0.1076000    
 H   -5.246200      -4.397100      4.3800000E-02
 H   -7.123600      -2.781400      0.1214000    


%chk=000149897-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149897

0 1
O 1.480457 3.975861 -0.382928
O -0.895142 -2.009370 -0.061720
O -5.123655 1.520078 0.310219
N 4.553202 -1.861782 -0.327753
N 2.383456 1.950204 0.316603
C 4.707230 1.183439 -0.017967
C 4.451569 0.449224 -1.352099
C 3.793281 2.407415 0.218814
C 5.093034 -0.958810 -1.381627
C 5.520654 -2.922174 0.068664
C 3.214587 -2.412696 -0.684312
C 4.198606 3.208541 1.477875
C 1.322518 2.766679 -0.012195
C -0.062958 2.161838 0.076621
C 6.662847 -2.396703 0.959966
C 2.404245 -2.887453 0.537245
C -1.644159 0.280093 0.087439
C -2.736698 1.192121 0.172982
C -0.317859 0.772360 0.042883
C -1.159215 3.064899 0.142789
C -3.282755 -1.684511 0.084708
C -4.375595 -0.772236 0.178718
C -1.871160 -1.197138 0.030619
C -2.478723 2.585474 0.198503
C -4.149927 0.706149 0.226421
C -3.534308 -3.078283 0.040711
C -5.701386 -1.268511 0.226450
C -4.856372 -3.563433 0.088836
C -5.942645 -2.656267 0.181854
H 4.579347 0.453993 0.808635
H 5.759393 1.526936 0.026745
H 3.360889 0.366703 -1.527184
H 4.852711 1.041578 -2.198948
H 3.829593 3.088844 -0.652830
H 4.969412 -1.402629 -2.401629
H 6.181237 -0.851785 -1.215349
H 4.963276 -3.690155 0.634288
H 5.948158 -3.438730 -0.828873
H 2.645456 -1.610483 -1.190002
H 3.302448 -3.245464 -1.428352
H 3.512735 4.059433 1.627082
H 5.223680 3.606318 1.364458
H 4.175198 2.567719 2.378933
H 2.217083 1.021844 0.711563
H 7.285958 -1.646301 0.440166
H 6.247974 -1.924803 1.867922
H 7.327144 -3.227103 1.264372
H 2.847380 -3.782081 1.011043
H 2.366994 -2.087099 1.298981
H 1.368276 -3.129079 0.242603
H 0.482722 0.029783 -0.051037
H -0.937114 4.136554 0.134229
H -3.332148 3.267911 0.257067
H -2.678186 -3.756328 -0.031461
H -6.520602 -0.546130 0.297821
H -5.045743 -4.641465 0.054239
H -6.969502 -3.034988 0.218898


