%chk=000252778.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252778

0 1
O -0.595757 2.064280 1.203001
O -2.292945 2.776269 -0.073535
O 0.752898 2.116912 -1.519945
O 1.630174 2.827084 0.325659
N 1.311364 1.943140 -0.452183
C 0.102740 -2.812371 0.029749
C -0.748916 -0.543985 -0.033742
C 0.728170 -0.477773 -0.002262
C -1.113121 -1.930804 -0.095489
C 1.230301 -1.818207 0.116816
C -1.772814 0.400280 0.024606
C 1.668363 0.543815 -0.098440
C -2.428488 -2.343839 -0.219627
C 2.579818 -2.091644 0.255710
C -3.114811 -0.021651 -0.125228
C 3.044958 0.282160 0.067974
C -3.437715 -1.367291 -0.261275
C 3.491672 -1.020959 0.256523
C -1.619158 1.850770 0.308374
H 0.044187 -3.462058 0.926098
H 0.221935 -3.488839 -0.840687
H -2.682429 -3.400923 -0.279999
H 2.936800 -3.115695 0.358957
H -3.906475 0.735364 -0.130643
H 3.757254 1.111457 0.044831
H -4.478106 -1.669244 -0.385579
H 4.556089 -1.217806 0.391460
H -0.445587 3.033958 1.408475


%chk=000252778-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000252778

0 1
O -0.587131 2.065468 1.289063
O -2.442313 2.775521 0.088287
O 0.407540 2.061029 -1.383655
O 2.098459 2.894226 -0.105197
N 1.372380 1.918216 -0.537737
C 0.104174 -2.821732 0.041501
C -0.752717 -0.552201 -0.031139
C 0.733476 -0.485199 0.003754
C -1.116836 -1.936292 -0.104494
C 1.237667 -1.820675 0.136965
C -1.796983 0.418572 0.023382
C 1.703175 0.548875 -0.095261
C -2.451240 -2.348428 -0.258160
C 2.606536 -2.095901 0.292624
C -3.137516 -0.006278 -0.170214
C 3.080622 0.291076 0.092682
C -3.466782 -1.368386 -0.332441
C 3.532562 -1.026225 0.306462
C -1.652454 1.856070 0.399877
H 0.028060 -3.463845 0.940848
H 0.245447 -3.500822 -0.821971
H -2.699475 -3.413828 -0.319843
H 2.953308 -3.129751 0.397533
H -3.919983 0.759092 -0.160411
H 3.779940 1.129558 0.035200
H -4.511171 -1.662582 -0.477400
H 4.601282 -1.218187 0.442271
H -0.529625 3.035030 1.507071


