%chk=000276032.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276032

0 1
O -4.798644 1.267485 -0.001230
O 4.469642 0.526619 0.000890
O 3.445740 -1.521530 0.000269
N 1.008732 -0.051407 0.000265
N 2.244017 0.536119 0.000347
C -1.388642 0.077181 0.000506
C -2.510116 0.915045 -0.000420
C -3.789509 0.327875 -0.000240
C -1.551722 -1.320822 0.001603
C -3.970740 -1.060834 0.000845
C -2.832218 -1.873851 0.001756
C -0.051153 0.711062 0.000315
C 5.782047 -0.147232 0.000907
C 6.763969 1.002499 0.001552
C -6.165691 0.791254 -0.001239
C 3.371194 -0.320302 0.000467
H -2.425383 1.998445 -0.001297
H -0.672760 -1.968623 0.002288
H -4.958084 -1.507387 0.000983
H -2.950217 -2.958336 0.002597
H -0.056460 1.811740 0.000555
H 5.833199 -0.777224 0.905903
H 5.833567 -0.776521 -0.904554
H 7.799041 0.638565 0.001555
H 6.631998 1.645760 -0.879835
H 6.631727 1.645007 0.883447
H 2.391258 1.553838 0.000585
H -6.367415 0.214321 0.905779
H -6.366892 0.212820 -0.907415
H -6.730681 1.732635 -0.002183


%chk=000276032-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276032

0 1
O -4.841984 1.340939 -0.000928
O 4.496740 0.576951 0.000818
O 3.534143 -1.581792 0.001616
N 1.020509 -0.197378 0.000677
N 2.252892 0.421266 0.000526
C -1.397509 0.005687 0.000296
C -2.507408 0.884363 -0.000364
C -3.826010 0.370588 -0.000241
C -1.614861 -1.404480 0.001087
C -4.046969 -1.028805 0.000546
C -2.928671 -1.901167 0.001201
C -0.044685 0.577599 0.000176
C 5.850801 -0.047102 0.001234
C 6.860848 1.095953 0.001283
C -6.227956 0.867584 -0.000850
C 3.425072 -0.339832 0.001056
H -2.371967 1.972144 -0.000974
H -0.749038 -2.072585 0.001593
H -5.059120 -1.443844 0.000661
H -3.099715 -2.983504 0.001817
H 0.028532 1.685043 -0.000359
H 5.939719 -0.689328 0.896263
H 5.940131 -0.689609 -0.893554
H 7.886617 0.684585 0.001559
H 6.740737 1.729037 -0.894608
H 6.740352 1.729288 0.896944
H 2.359243 1.446408 0.000059
H -6.449363 0.268629 0.904402
H -6.449121 0.267606 -0.905485
H -6.842154 1.779957 -0.001451


