%chk=000181847.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181847

1 1
O 5.370121 1.245375 -0.668822
O 5.945885 -0.950297 0.028050
O -5.064288 -1.902360 -0.442682
O -5.885606 0.817021 -0.713590
N 0.074466 1.798387 0.178427
C 0.511863 0.447323 0.113284
C -0.484835 -0.559993 0.134939
C 1.911867 0.077569 0.041716
C -1.880041 -0.229671 -0.052695
C 2.257386 -1.270388 0.338471
C -2.234684 1.145905 -0.153878
C -0.087882 -1.917402 0.367015
C -1.230089 2.125802 0.023317
C 2.940965 0.990982 -0.378283
C 1.224955 -2.249172 0.526388
C 3.626273 -1.708291 0.397076
C 4.229876 0.552207 -0.335991
C 4.581223 -0.793887 0.075049
C -2.892097 -1.210179 -0.151913
C 1.001188 2.896019 0.549028
C -3.596642 1.522752 -0.383294
C -4.219506 -0.856828 -0.368068
C -4.563495 0.554663 -0.491121
C 6.499383 0.324501 -0.451801
C -6.487446 -1.669041 -0.673798
H -0.868305 -2.684012 0.433776
H -1.517341 3.191851 0.060456
H 2.712629 1.976695 -0.780233
H 1.517732 -3.277961 0.763060
H 3.870461 -2.734460 0.674354
H -2.643674 -2.274782 -0.068805
H 1.686322 2.578636 1.365310
H 1.623847 3.208429 -0.318001
H 0.463856 3.791039 0.915077
H -3.848752 2.579680 -0.472355
H 7.127372 0.743599 0.347537
H 6.976853 0.141777 -1.425595
H -6.068186 1.796304 -0.796808
H -6.909992 -1.079431 0.146848
H -6.871510 -2.699621 -0.674760
H -6.635551 -1.180442 -1.642786


%chk=000181847-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181847

1 1
O 5.459300 1.253747 -0.630416
O 6.026259 -0.991653 -0.002498
O -5.139780 -1.868882 -0.400457
O -5.941696 0.910327 -0.743113
N 0.091443 1.808742 0.145876
C 0.533114 0.452770 0.116371
C -0.482777 -0.567609 0.144868
C 1.942610 0.094299 0.067921
C -1.885111 -0.225794 -0.050128
C 2.292867 -1.290347 0.348495
C -2.233836 1.167561 -0.203785
C -0.079793 -1.925024 0.372874
C -1.220696 2.131182 -0.043125
C 2.999796 1.000173 -0.310728
C 1.252968 -2.261715 0.531080
C 3.661015 -1.727442 0.373577
C 4.304102 0.535307 -0.290911
C 4.641446 -0.801166 0.069675
C -2.928444 -1.177649 -0.121115
C 0.971058 2.945153 0.573447
C -3.592652 1.551960 -0.434062
C -4.271159 -0.810234 -0.353295
C -4.603311 0.596553 -0.515728
C 6.602276 0.305721 -0.461986
C -6.602669 -1.767789 -0.653579
H -0.838559 -2.706342 0.448040
H -1.460993 3.197303 -0.022528
H 2.814177 2.007389 -0.676775
H 1.534844 -3.297002 0.748663
H 3.904034 -2.769067 0.596339
H -2.744058 -2.248616 -0.018996
H 1.774842 2.572276 1.221240
H 1.401463 3.468913 -0.295123
H 0.360039 3.654595 1.152013
H -3.836617 2.615888 -0.546482
H 7.278359 0.694385 0.315579
H 7.090235 0.155973 -1.437993
H -6.087101 1.883812 -0.848780
H -7.090674 -1.173089 0.132882
H -6.937882 -2.813734 -0.621902
H -6.793837 -1.322579 -1.641539


