%chk=000201778.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201778

0 1
O -4.218157 0.665045 0.102193
O 0.827530 2.274027 -0.515783
N -0.845005 -0.389229 0.695870
N 1.585015 0.139391 -0.844887
C -0.514600 -0.947527 -1.754044
C 0.818925 -2.139822 -0.029881
C -1.500587 -0.447728 -0.660533
C 0.043665 -2.321217 -1.344847
C 2.016997 -1.163324 -0.256288
C -0.162983 -1.671468 1.064893
C 0.674767 0.002145 -2.017275
C -2.030782 0.959928 -0.998911
C 2.844385 -1.015631 1.041197
C -1.862002 -0.037378 1.745949
C -3.011715 1.467077 0.060931
C -2.421177 1.365761 1.471301
C 3.374300 0.403467 1.256106
C 1.440960 1.309885 -0.071451
C 2.210282 1.391587 1.228754
H -1.089680 -1.046007 -2.705443
H 1.243584 -3.122043 0.288098
H -2.373189 -1.156795 -0.646937
H -0.771812 -3.055742 -1.217206
H 0.696248 -2.730021 -2.136737
H 2.681032 -1.624490 -1.040583
H -0.878051 -2.494657 1.282980
H 0.404014 -1.474928 2.005655
H 1.278813 -0.375973 -2.870636
H 0.307513 1.017363 -2.305367
H -1.166247 1.674518 -1.040574
H -2.486344 0.968456 -2.001549
H 3.683517 -1.735319 1.017288
H 2.226879 -1.299763 1.920778
H -1.361164 -0.049550 2.736398
H -2.704848 -0.763956 1.787701
H -3.336779 2.508226 -0.165474
H -3.200665 1.605861 2.219682
H -1.616218 2.122170 1.575807
H 4.111514 0.663133 0.469748
H 3.914270 0.470898 2.219102
H 2.561323 2.433132 1.374719
H 1.495475 1.194595 2.056712
H -4.534200 0.468104 -0.794254


%chk=000201778-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201778

0 1
O -4.376911 0.510088 0.030911
O 1.186117 2.490608 -0.648077
N -0.982942 -0.487791 0.721940
N 1.519742 0.185444 -0.701603
C -0.504244 -0.898550 -1.727319
C 0.785814 -2.127641 0.004742
C -1.548597 -0.456707 -0.660734
C 0.075879 -2.284217 -1.360441
C 1.974192 -1.112951 -0.126246
C -0.295449 -1.757048 1.047489
C 0.682924 0.075825 -1.915939
C -2.113455 0.952813 -0.947612
C 2.760250 -0.939342 1.190667
C -2.019302 -0.167235 1.739137
C -3.172329 1.376349 0.089273
C -2.611945 1.234770 1.512513
C 3.626869 0.333712 1.161401
C 1.734391 1.444986 -0.161215
C 2.688778 1.549020 1.028265
H -1.037649 -0.958256 -2.697864
H 1.234088 -3.094531 0.312251
H -2.399920 -1.189035 -0.729358
H -0.725040 -3.045550 -1.287935
H 0.785705 -2.622390 -2.141626
H 2.665990 -1.562269 -0.878094
H -1.016759 -2.618615 1.095613
H 0.138566 -1.659236 2.061025
H 1.311227 -0.305518 -2.750261
H 0.358684 1.095307 -2.175318
H -1.288999 1.690017 -0.915297
H -2.547466 0.974127 -1.969206
H 3.373347 -1.846203 1.348851
H 2.062049 -0.863607 2.045181
H -1.546181 -0.214274 2.738789
H -2.846878 -0.919767 1.720444
H -3.473688 2.429623 -0.095580
H -3.419942 1.424705 2.242373
H -1.823982 1.997392 1.654229
H 4.330916 0.300477 0.306368
H 4.235051 0.412689 2.081582
H 3.241094 2.496654 0.905368
H 2.074856 1.656155 1.944889
H -4.740045 0.542176 -0.890375


