%chk=000151117.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151117

0 1
 O    5.277600       2.038100      0.3627000    
 O    4.786700      -1.403700       1.043300    
 O    1.255900       3.064200     -0.4639000    
 O    6.604500      0.4898000       1.301200    
 O   -4.936700       1.940700     -0.2815000    
 N   0.5882000      0.8636000     -0.2232000    
 N  -0.4303000      -2.571400      0.1059000    
 N   -3.724700       1.308200      2.7799999E-02
 C    4.674800     -0.3311000      0.1048000    
 C    3.241800      0.1160000      1.3000000E-02
 C   0.9118000     -0.4723000     -5.2099999E-02
 C  -0.8744000       1.045700     -0.3268000    
 C    2.954900       1.418000     -0.1660000    
 C   -1.376800     -0.3544000     -0.1977000    
 C  -0.3233000      -1.243000     -3.7000000E-02
 C    2.179500     -0.8769000      6.1799999E-02
 C    1.526300       1.877000     -0.2986000    
 C    5.206800     -0.8011000      -1.251300    
 C    4.035700       2.440700     -0.2554000    
 C   -2.657700     -0.8532000     -0.2158000    
 C    5.592200      0.7546000      0.6553000    
 C   -2.832300      -2.239500     -7.0699997E-02
 C   -1.684600      -3.066900      8.8900000E-02
 C    6.618700      -1.273700      -1.152800    
 C   -3.768600      7.6899998E-02 -0.3870000    
 C   -4.115300      -2.809500     -8.0700003E-02
 C   -1.882600      -4.436300      0.2314000    
 C   -4.278300      -4.184400      6.4900003E-02
 C   -3.162000      -4.997200      0.2204000    
 C   -4.865100       3.281200      0.1801000    
 C   -3.701000       3.976400     -0.5243000    
 C   -6.187700       3.959600     -0.1702000    
 C   -4.654200       3.263900       1.693400    
 H   -1.103600       1.499200      -1.295700    
 H   -1.184800       1.694300      0.4973000    
 H    2.429000      -1.925100      0.1811000    
 H    5.141700     -1.9999999E-04  -1.998400    
 H    4.595100      -1.635200      -1.618700    
 H    4.244800       2.695000      -1.299700    
 H    3.734100       3.358700      0.2595000    
 H    7.322500     -0.4564000     -0.9689000    
 H    6.759400      -2.036400     -0.3805000    
 H    6.921100      -1.727500      -2.103800    
 H    4.394100      -1.115400       1.885500    
 H   -4.681300     -0.2896000     -0.8867000    
 H   -5.019400      -2.217900     -0.1839000    
 H   -1.026300      -5.097000      0.3554000    
 H   -5.273200      -4.619600      6.0100000E-02
 H   -3.283000      -6.070600      0.3351000    
 H   -3.771000       3.851800      -1.611100    
 H   -3.691800       5.049400     -0.3023000    
 H   -2.726500       3.577900     -0.2232000    
 H   -7.030000       3.434100      0.2943000    
 H   -6.364700       3.932500      -1.251500    
 H   -6.207400       5.003800      0.1582000    
 H   -3.680100       2.850900       1.978100    
 H   -4.711700       4.275500       2.110400    
 H   -5.413900       2.646100       2.186200    


%chk=000151117-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000151117

0 1
O 5.161217 1.861738 0.980230
O 4.888483 -1.811840 0.615234
O 1.133796 2.954118 0.063201
O 6.380678 0.106927 1.796661
O -4.992110 1.991469 -0.030244
N 0.571129 0.677579 0.064173
N -0.507671 -2.757748 0.087225
N -3.732986 1.303276 0.001237
C 4.702975 -0.458023 0.108440
C 3.220941 -0.092642 0.119395
C 0.890180 -0.680907 0.086307
C -0.895619 0.927814 0.041188
C 2.896699 1.266562 0.107055
C -1.459885 -0.472039 0.048951
C -0.381191 -1.420653 0.074721
C 2.212311 -1.103137 0.117175
C 1.515028 1.735147 0.078184
C 5.263932 -0.381414 -1.355326
C 3.982359 2.307283 0.161797
C -2.789330 -0.922525 0.034861
C 5.480384 0.518502 1.030296
C -2.986111 -2.368490 0.049311
C -1.812942 -3.235129 0.075430
C 6.766660 -0.703696 -1.459325
C -3.930127 -0.003812 0.006565
C -4.275185 -2.993092 0.040122
C -1.979965 -4.656884 0.090619
C -4.407619 -4.384984 0.055528
C -3.253224 -5.226721 0.080957
C -4.801966 3.506551 -0.028069
C -4.013687 3.915291 -1.285116
C -6.259620 3.994165 -0.070350
C -4.087437 3.919609 1.271000
H -1.175305 1.516285 -0.851200
H -1.197765 1.536201 0.912697
H 2.469032 -2.161167 0.161443
H 5.049169 0.613818 -1.789227
H 4.679885 -1.119152 -1.937017
H 4.371829 2.578629 -0.838106
H 3.621656 3.223294 0.653821
H 7.389874 0.033026 -0.921240
H 6.978153 -1.703019 -1.042161
H 7.081251 -0.703345 -2.518142
H 5.635789 -1.774940 1.276666
H -4.954100 -0.399396 -0.010713
H -5.183516 -2.383404 0.021780
H -1.070164 -5.263985 0.110956
H -5.406224 -4.835004 0.048526
H -3.372685 -6.315134 0.093353
H -4.525767 3.565690 -2.198691
H -3.926788 5.015660 -1.332897
H -2.996174 3.490461 -1.263405
H -6.819747 3.630271 0.808287
H -6.766884 3.635072 -0.982425
H -6.283693 5.098124 -0.067916
H -3.072658 3.489838 1.312850
H -3.997669 5.019792 1.317356
H -4.654695 3.578390 2.154673


