%chk=000157363.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157363

0 1
 O   -1.062900       1.920200      0.1231000    
 O    2.173100      -3.424300      0.4593000    
 O   -4.642100      -2.037600     -0.1767000    
 N    4.916700       1.320100     -2.0199999E-02
 N    2.649100      -1.352400     -0.4667000    
 C    4.433200      0.4584000       1.051700    
 C    4.723500      -1.018200      0.7743000    
 C    4.083600      -1.519100     -0.5219000    
 C    4.572100       2.717800      0.2464000    
 C    6.364500       1.177000     -0.1836000    
 C   -1.440200     -0.3955000      4.9000001E-03
 C   -2.375500      -1.429500     -7.4299999E-02
 C   0.3543000      -2.019800     -7.4000000E-03
 C    3.072500       2.890000      0.4196000    
 C    6.872400       2.019700      -1.341200    
 C   -3.328900       1.312000      1.7899999E-02
 C   -4.264200      0.2778000     -6.0899999E-02
 C  -7.2400004E-02 -0.6923000      3.8500000E-02
 C    1.775200      -2.328200      2.6600000E-02
 C   -1.882800       1.012900      5.3599998E-02
 C   -3.821700      -1.130600     -0.1096000    
 C   -1.942900      -2.760200     -0.1203000    
 C  -0.5790000      -3.051600     -8.6800002E-02
 C   -3.761400       2.642700      6.3900001E-02
 C   -5.632000      0.5746000     -9.3699999E-02
 C   -5.125500       2.933900      3.0999999E-02
 C   -6.058700       1.902100     -4.7600001E-02
 H    4.891800      0.7326000       2.011400    
 H    3.351300      0.5438000       1.190500    
 H    4.311700      -1.596500       1.613000    
 H    5.794700      -1.242400      0.7796000    
 H    4.315800      -2.580300     -0.6608000    
 H    4.452300     -0.9771000      -1.397900    
 H    5.091700       3.107300       1.130900    
 H    4.845600       3.350400     -0.6043000    
 H    6.909000       1.437700      0.7327000    
 H    6.632700      0.1493000     -0.4442000    
 H    2.283100     -0.4968000     -0.8702000    
 H    2.508400       2.377500     -0.3674000    
 H    2.719800       2.544400       1.396200    
 H    2.818000       3.954500      0.3595000    
 H    6.266400       1.878700      -2.242900    
 H    6.908400       3.086200      -1.099000    
 H    7.898100       1.722700      -1.588700    
 H   0.6396000      0.1223000      0.1352000    
 H   -2.650800      -3.582400     -0.1832000    
 H  -0.2650000      -4.091400     -0.1282000    
 H   -3.053800       3.465100      0.1254000    
 H   -6.379700     -0.2117000     -0.1548000    
 H   -5.460400       3.966600      6.6799998E-02
 H   -7.120100       2.131600     -7.3100001E-02


%chk=000157363-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000157363

0 1
O -0.576867 2.080330 -0.846344
O 2.391141 -3.641961 -0.194343
O -4.390283 -1.709395 0.416106
N 4.440834 1.117960 0.375098
N 3.090488 -1.422864 -0.317533
C 4.848379 0.111538 1.404381
C 5.319580 -1.251021 0.830771
C 4.522110 -1.734818 -0.411056
C 3.837536 2.324917 1.029609
C 5.577917 1.512385 -0.515518
C -1.083029 -0.221038 -0.321540
C -2.065070 -1.197946 0.017462
C 0.683977 -1.920522 -0.150713
C 2.387290 2.127948 1.507430
C 5.104949 2.089933 -1.862717
C -2.910213 1.557801 -0.505598
C -3.894117 0.579678 -0.172740
C 0.279117 -0.592093 -0.408087
C 2.120964 -2.395004 -0.223959
C -1.460542 1.201521 -0.581193
C -3.513245 -0.840083 0.110354
C -1.658636 -2.533025 0.263807
C -0.301822 -2.890339 0.179916
C -3.307521 2.892825 -0.765007
C -5.258816 0.952922 -0.104640
C -4.667600 3.255056 -0.697009
C -5.645645 2.282704 -0.365718
H 5.646909 0.517427 2.075316
H 3.964637 -0.068048 2.042607
H 5.227182 -1.997194 1.642401
H 6.391959 -1.217595 0.557701
H 4.620063 -2.826404 -0.532734
H 4.920830 -1.249608 -1.322556
H 4.478598 2.652247 1.886109
H 3.850759 3.147874 0.293358
H 6.247849 2.243435 0.001000
H 6.190576 0.615053 -0.711890
H 2.903214 -0.411836 -0.260667
H 1.704650 1.974881 0.653509
H 2.284686 1.273384 2.200625
H 2.045949 3.030845 2.047162
H 4.486983 1.350544 -2.402305
H 4.499926 3.005132 -1.734372
H 5.973312 2.350063 -2.496017
H 0.986635 0.190106 -0.701501
H -2.427795 -3.268763 0.518033
H 0.037372 -3.916215 0.355096
H -2.531873 3.622778 -1.016887
H -5.992102 0.182661 0.154322
H -4.970394 4.287741 -0.900049
H -6.702201 2.566082 -0.313079


