%chk=000187928.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187928

0 1
O 3.063599 2.187936 0.262762
O 1.099559 2.502652 1.292632
N 1.157593 -0.252695 -0.176692
N -3.629585 0.289906 -0.814978
C -0.070612 -1.016310 -0.599188
C -0.085338 -2.375160 0.142498
C 1.185988 -3.179704 -0.142370
C 2.419718 -1.002611 -0.491554
C 2.419805 -2.353780 0.237714
C -1.332907 -0.259126 -0.238159
C 1.216257 1.120695 -0.759171
C -1.445980 0.487010 0.944371
C -2.453900 -0.329804 -1.089437
C 1.702785 1.992514 0.382640
C -2.650038 1.131490 1.235575
C -3.720004 1.009097 0.334106
H -0.055616 -1.209015 -1.705921
H -0.984557 -2.945151 -0.155524
H -0.179377 -2.196682 1.233413
H 1.229938 -3.469192 -1.209328
H 1.169988 -4.127013 0.429298
H 3.273607 -0.380803 -0.134069
H 2.563291 -1.158325 -1.582525
H 2.432158 -2.182838 1.333635
H 3.347796 -2.904738 -0.001458
H 0.213887 1.488437 -1.082228
H 1.889782 1.221323 -1.639887
H -0.588774 0.577778 1.621086
H -2.425823 -0.900112 -2.024818
H -2.754858 1.722422 2.143044
H -4.683601 1.495797 0.521425
H 3.443118 2.734300 1.000006


%chk=000187928-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187928

0 1
O 2.349161 3.193066 -0.399203
O 2.745539 1.704432 1.339219
N 1.166512 -0.306228 -0.052428
N -3.553672 0.498693 -0.994177
C -0.043813 -1.011273 -0.574781
C -0.160550 -2.423238 0.068512
C 1.121733 -3.258534 -0.116731
C 2.421381 -1.093984 -0.212637
C 2.325972 -2.478655 0.449049
C -1.318470 -0.230262 -0.270892
C 1.316536 1.047477 -0.606273
C -1.544130 0.336364 1.010176
C -2.354582 -0.113873 -1.229930
C 2.205554 1.949596 0.242375
C -2.771952 0.978769 1.272814
C -3.747155 1.032205 0.247897
H 0.028025 -1.151660 -1.687259
H -1.037692 -2.933731 -0.371185
H -0.362962 -2.293448 1.149329
H 1.284978 -3.465320 -1.194850
H 1.012952 -4.237454 0.386745
H 3.240815 -0.515919 0.247833
H 2.663948 -1.225421 -1.300955
H 2.209446 -2.348949 1.541878
H 3.271023 -3.027489 0.275427
H 0.330574 1.543542 -0.663388
H 1.727299 1.062247 -1.647256
H -0.752136 0.279513 1.765534
H -2.224661 -0.528493 -2.238356
H -2.977172 1.429419 2.249248
H -4.715518 1.518015 0.414358
H 2.910917 3.788888 0.166803


