%chk=000154488.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154488

1 1
 O  -0.2734000       2.730900      0.9501000    
 N  -0.4489000       1.995600      -1.142300    
 C   6.6000000E-03  0.2979000      0.5977000    
 C  -0.2421000       1.696500      8.4399998E-02
 C    1.376600     -0.3106000      0.2461000    
 C   -1.181900     -0.6178000      0.2461000    
 C   5.2999999E-02  0.7338000       2.039100    
 C  -9.4899997E-02   2.048700       2.127100    
 C    1.774800      -1.514300      0.8275000    
 C  -0.9551000      -1.867000     -0.3347000    
 C    2.219500      0.3419000     -0.6536000    
 C   -2.488400     -0.2006000      0.5068000    
 C  -0.6874000       3.399400      -1.575900    
 C  -0.4633000      0.9572000      -2.208800    
 C    3.015800      -2.065700      0.5092000    
 C   -2.030800      -2.696000     -0.6532000    
 C    3.460500     -0.2096000     -0.9719000    
 C   -3.564100      -1.029600      0.1884000    
 C    3.858800      -1.413400     -0.3906000    
 C   -3.335300      -2.277300     -0.3916000    
 H   0.1845000      7.6300003E-02   2.887100    
 H  -0.1045000       2.658400       3.013100    
 H    1.149000      -2.029100       1.552300    
 H   1.3600000E-02  -2.240600     -0.6364000    
 H    1.995400       1.301600      -1.101400    
 H   -2.697100      0.7642000      0.9606000    
 H   0.2528000       3.949800      -1.486300    
 H   -1.467500       3.840900     -0.9492000    
 H   -1.024700       3.402900      -2.616100    
 H   -1.508600      0.7438000      -2.449400    
 H   6.2600002E-02  4.2500000E-02  -1.963100    
 H   2.4800001E-02   1.382500      -3.092000    
 H    3.328900      -2.999500      0.9669000    
 H   -1.855000      -3.661000      -1.119800    
 H    4.122600      0.3036000      -1.663400    
 H   -4.580000     -0.7035000      0.3916000    
 H    4.826800      -1.840600     -0.6354000    
 H   -4.173000      -2.921100     -0.6430000    


%chk=000154488-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154488

1 1
O -0.333091 2.658932 0.827484
N -0.439538 1.975282 -1.373870
C 0.018631 0.289168 0.561537
C -0.241889 1.655582 -0.101973
C 1.411878 -0.310282 0.228370
C -1.199616 -0.642974 0.267929
C 0.061623 0.726271 2.035157
C -0.115889 2.055456 2.146019
C 1.722132 -1.603749 0.722531
C -1.114730 -1.720171 -0.648570
C 2.418247 0.436918 -0.431928
C -2.439627 -0.371018 0.902887
C -0.814177 3.360489 -1.781803
C -0.358034 0.979053 -2.475571
C 3.009093 -2.148501 0.532076
C -2.248144 -2.520687 -0.912751
C 3.706480 -0.112050 -0.622978
C -3.572308 -1.169173 0.632662
C 4.005436 -1.406667 -0.144791
C -3.480417 -2.247890 -0.276301
H 0.249071 0.024365 2.846064
H -0.128685 2.779625 2.955746
H 0.962260 -2.188567 1.252746
H -0.166327 -1.957583 -1.141521
H 2.222702 1.455155 -0.791266
H -2.522841 0.448981 1.625847
H 0.019411 3.813489 -2.345115
H -1.038703 3.974468 -0.900348
H -1.702192 3.303738 -2.433026
H -1.361169 0.570085 -2.684733
H 0.326481 0.162147 -2.214983
H 0.022255 1.492377 -3.372785
H 3.235048 -3.148553 0.915822
H -2.165861 -3.359191 -1.611979
H 4.475143 0.474249 -1.136819
H -4.520342 -0.955005 1.136565
H 5.004235 -1.830142 -0.290041
H -4.355946 -2.872525 -0.480291


