%chk=000182406.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182406

1 1
O -6.242268 -0.689244 0.045255
O -4.540948 -2.617665 0.836482
O 5.756591 0.053579 -0.040894
O 4.673577 -2.543546 -0.172076
N -0.188573 1.531390 0.140305
C -1.148528 2.682055 0.216142
C -2.384715 2.405559 -0.642663
C -0.686999 0.217334 0.087532
C -2.994505 1.081656 -0.279349
C -2.144155 0.030921 0.104978
C 1.158373 1.781624 0.121335
C 0.219540 -0.831243 0.002976
C 2.093055 0.738455 0.055356
C 1.617622 -0.616404 -0.009646
C -4.387506 0.902352 -0.328442
C -2.691125 -1.214432 0.491542
C -4.926305 -0.328410 0.030324
C -4.065898 -1.396787 0.455078
C 3.507731 0.994804 0.046543
C 2.552983 -1.680850 -0.086560
C 4.395063 -0.044296 -0.025327
C 3.913625 -1.433513 -0.095839
C -7.230922 0.293172 -0.369362
C 6.351181 1.380777 0.027183
C 6.127896 -2.436174 -0.187976
H -0.648422 3.622671 -0.109496
H -1.442020 2.817535 1.289033
H -2.135172 2.413674 -1.729058
H -3.112160 3.238441 -0.511694
H 1.494772 2.829348 0.163068
H -0.157711 -1.860888 -0.064218
H -5.031191 1.721428 -0.644335
H -2.058478 -2.039314 0.826774
H 3.846804 2.028609 0.099104
H 2.200118 -2.716092 -0.138798
H -5.541187 -2.658494 0.776794
H -7.066860 0.577623 -1.412827
H -7.216902 1.151983 0.307822
H -8.163797 -0.280979 -0.259236
H 6.062076 1.972327 -0.846238
H 7.424006 1.135671 -0.002684
H 6.088861 1.867195 0.971132
H 6.454136 -1.874195 -1.069748
H 6.416286 -3.495836 -0.253343
H 6.481548 -1.978422 0.742153


%chk=000182406-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000182406

1 1
O -6.315867 -0.698078 0.028483
O -4.648858 -2.659372 0.767634
O 5.818528 0.128291 -0.056336
O 4.745849 -2.550682 -0.124556
N -0.188513 1.519001 0.120693
C -1.153297 2.661970 0.251964
C -2.383613 2.424656 -0.633877
C -0.698357 0.202840 0.092785
C -3.018201 1.094055 -0.267517
C -2.161200 0.019538 0.110860
C 1.154451 1.775743 0.093830
C 0.227790 -0.846771 0.028403
C 2.113201 0.747342 0.043668
C 1.635887 -0.625064 0.012516
C -4.416287 0.902198 -0.313134
C -2.726300 -1.240005 0.460117
C -4.966367 -0.351245 0.019001
C -4.111571 -1.429382 0.415593
C 3.520696 1.011342 0.018582
C 2.585749 -1.675988 -0.046056
C 4.442004 -0.036525 -0.033500
C 3.967981 -1.423042 -0.068690
C -7.312272 0.316557 -0.352953
C 6.364000 1.497695 -0.020264
C 6.230882 -2.585975 -0.159138
H -0.622140 3.586604 -0.026050
H -1.454656 2.726958 1.314380
H -2.086887 2.442604 -1.701653
H -3.092810 3.256929 -0.482128
H 1.445847 2.829222 0.118527
H -0.148175 -1.870002 -0.035939
H -5.064013 1.733326 -0.608411
H -2.114369 -2.079838 0.798728
H 3.866931 2.048613 0.042666
H 2.265408 -2.721315 -0.074401
H -5.639540 -2.626220 0.688969
H -7.144396 0.653025 -1.392301
H -7.277192 1.174928 0.342557
H -8.283643 -0.190126 -0.274850
H 6.034715 2.072762 -0.905237
H 7.454245 1.367159 -0.042796
H 6.064786 2.012591 0.911208
H 6.611062 -2.070818 -1.054147
H 6.456043 -3.660991 -0.200203
H 6.651966 -2.131111 0.750073


