%chk=000201974.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201974

0 1
O -1.944196 -0.026449 -0.337843
O 4.182433 0.237372 1.602072
N 4.381099 -0.929673 -0.326878
C 0.039632 -1.313590 -0.054337
C 0.137662 1.141552 0.192025
C -0.584804 -0.048575 -0.030005
C -0.757583 -2.563064 -0.304953
C -0.528984 2.489252 0.181536
C 1.422919 -1.376033 0.153471
C 1.518659 1.043612 0.403482
C 2.152222 -0.204244 0.380300
C -0.441635 -3.170745 -1.670894
C -1.005488 2.859009 -1.222224
C 3.626284 -0.256874 0.636714
C -2.819356 0.307912 0.788128
C -4.194798 0.190079 0.211710
C -5.300610 0.381683 0.925315
H -0.561048 -3.302501 0.498148
H -1.845921 -2.332081 -0.248854
H 0.156271 3.271090 0.567644
H -1.398215 2.480629 0.881238
H 1.924004 -2.344152 0.152730
H 2.108566 1.943028 0.593088
H -0.645272 -2.454807 -2.477690
H -1.055088 -4.059409 -1.857659
H 0.609049 -3.468425 -1.752955
H -0.169642 2.916290 -1.928757
H -1.517202 3.826543 -1.229355
H -1.706292 2.102764 -1.607795
H -2.628616 -0.410384 1.604898
H -2.581495 1.340588 1.122763
H -4.210288 -0.067053 -0.852875
H 3.990270 -1.279484 -1.181913
H 5.384212 -0.971417 -0.236387
H -6.293408 0.297735 0.504975
H -5.309740 0.635119 1.975434


%chk=000201974-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201974

0 1
O -1.951393 0.074594 -0.319569
O 4.324914 0.957627 1.004778
N 4.423990 -1.250434 0.322267
C 0.081735 -1.254452 -0.009659
C 0.181329 1.233178 0.061809
C -0.549213 0.018528 -0.065449
C -0.709084 -2.535712 -0.227759
C -0.497568 2.584622 -0.102566
C 1.480008 -1.292228 0.200099
C 1.574408 1.146550 0.276530
C 2.236745 -0.102380 0.344595
C -1.009040 -2.786775 -1.730101
C -0.732606 2.933853 -1.597205
C 3.723757 -0.081024 0.586723
C -2.794123 0.121026 0.913414
C -4.210772 0.391277 0.485656
C -5.276424 -0.353941 0.867713
H -0.141422 -3.391583 0.185014
H -1.671291 -2.494759 0.314823
H 0.129717 3.366091 0.365097
H -1.473373 2.598682 0.416804
H 1.956694 -2.277508 0.283005
H 2.177537 2.053263 0.397356
H -1.610216 -1.957775 -2.140754
H -1.575667 -3.726493 -1.863781
H -0.073964 -2.861044 -2.314472
H 0.223852 2.962971 -2.149308
H -1.218058 3.922090 -1.696248
H -1.382606 2.177122 -2.069737
H -2.712380 -0.837658 1.463576
H -2.414078 0.931832 1.570624
H -4.346509 1.266373 -0.164672
H 3.998051 -2.066436 -0.110259
H 5.428643 -1.246977 0.493271
H -6.295172 -0.096877 0.558230
H -5.162821 -1.240325 1.504453


