%chk=000206380.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206380

0 1
O 0.510432 2.420495 -0.397873
O 1.495590 -2.086554 -0.544570
N -0.682245 -1.493958 -0.085679
N 1.025461 0.189477 -0.461965
C -1.612135 -0.476932 0.089882
C -3.072926 -0.669516 0.395601
C -3.625452 0.777912 0.481284
C -2.438364 1.743639 0.215691
C -1.258243 0.842267 -0.008536
C 0.085209 1.290593 -0.287668
C 0.698782 -1.182911 -0.372919
C -1.071224 -2.919637 0.022179
C 2.469623 0.520153 -0.686053
C 3.163563 0.782125 0.623728
C 4.295680 0.180026 0.977382
H -3.582479 -1.252796 -0.393266
H -3.223433 -1.218697 1.343183
H -4.068353 0.967686 1.472613
H -4.427591 0.933098 -0.258600
H -2.264611 2.424292 1.069416
H -2.622046 2.386759 -0.664705
H -0.185513 -3.567873 -0.154690
H -1.832255 -3.176405 -0.732859
H -1.458307 -3.145753 1.029279
H 2.517142 1.438636 -1.324341
H 2.946802 -0.312069 -1.256045
H 2.672199 1.525370 1.256250
H 4.808395 0.386662 1.906518
H 4.796897 -0.566091 0.375964


%chk=000206380-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000206380

0 1
O 0.496915 2.490229 -0.376160
O 1.569463 -2.089505 -0.535781
N -0.654613 -1.482070 -0.084205
N 1.018601 0.195619 -0.456600
C -1.589379 -0.466920 0.085659
C -3.054652 -0.691019 0.392580
C -3.639118 0.762028 0.487441
C -2.459700 1.764525 0.217788
C -1.265410 0.867626 -0.009837
C 0.093304 1.290200 -0.284127
C 0.708681 -1.177983 -0.369527
C -1.034293 -2.905670 0.022276
C 2.448636 0.549677 -0.715168
C 3.200545 0.827223 0.573452
C 4.235168 0.073848 1.018615
H -3.545864 -1.286849 -0.401122
H -3.187223 -1.255344 1.336040
H -4.078434 0.934490 1.484408
H -4.447194 0.900387 -0.250509
H -2.290791 2.448843 1.069573
H -2.652050 2.408078 -0.660433
H -0.125346 -3.502824 -0.143037
H -1.786661 -3.166684 -0.742379
H -1.439444 -3.126295 1.025189
H 2.432640 1.455196 -1.346862
H 2.902664 -0.290998 -1.261634
H 2.863923 1.708110 1.136962
H 4.765720 0.319511 1.945675
H 4.574511 -0.813430 0.470926


