%chk=000187790.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187790

0 1
O -2.536606 -0.076489 1.337496
O -4.127069 2.186641 -0.327316
O -3.984022 -1.341154 -1.797144
O 3.857358 -2.132867 -0.259492
N -0.262719 -0.188065 0.798850
N 1.592461 1.336413 -0.018695
N 0.925016 -2.151175 0.761025
N 3.652683 0.137340 -0.515585
N 3.464661 2.469719 -0.994439
C -1.401037 0.741946 1.023774
C -1.752884 1.577601 -0.217248
C -3.187690 1.163395 -0.612720
C -3.468068 -0.111784 0.219709
C -3.230515 -1.399812 -0.586187
C 1.021373 0.104961 0.324943
C -0.256455 -1.605465 1.059332
C 1.741038 -1.116166 0.300674
C 3.140108 -1.175868 -0.161526
C 2.953087 1.241017 -0.493269
H -1.213365 1.330010 1.955450
H -1.067715 1.397794 -1.067904
H -1.708838 2.663358 -0.015109
H -3.324692 1.002864 -1.709779
H -4.463210 -0.094598 0.711715
H -3.486149 -2.300764 -0.002561
H -2.181953 -1.484119 -0.940338
H -1.129044 -2.099922 1.463234
H -4.149788 2.408785 0.628197
H 1.021784 2.159238 -0.175214
H -4.936820 -1.497867 -1.623940
H 4.416288 2.383222 -1.364973
H 3.396181 3.263313 -0.365160


%chk=000187790-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187790

0 1
O -2.618829 -0.107586 1.318227
O -4.045409 2.331402 0.196283
O -3.995157 -1.199745 -2.054648
O 3.975999 -2.126820 0.133302
N -0.263568 -0.255099 0.847007
N 1.512609 1.228005 -0.148536
N 1.005824 -2.150097 1.072614
N 3.645361 0.121351 -0.472879
N 3.376890 2.366715 -1.073943
C -1.407961 0.674261 1.033631
C -1.713395 1.523667 -0.238935
C -3.235683 1.315133 -0.483375
C -3.482063 -0.091623 0.090729
C -3.124406 -1.243807 -0.873714
C 1.010612 0.037171 0.367405
C -0.197505 -1.607242 1.284729
C 1.786694 -1.128308 0.496602
C 3.199024 -1.139760 0.062792
C 2.870261 1.185737 -0.557974
H -1.222627 1.286405 1.935651
H -1.138672 1.150210 -1.104128
H -1.509954 2.598293 -0.099225
H -3.516848 1.389281 -1.543719
H -4.517536 -0.198812 0.458241
H -3.190125 -2.211340 -0.338351
H -2.100500 -1.139049 -1.268126
H -1.058882 -2.093338 1.731162
H -3.973725 2.195948 1.177356
H 0.954963 2.080190 -0.209168
H -4.891235 -1.552279 -1.824701
H 4.351027 2.341998 -1.365678
H 2.828216 3.210639 -1.212830


