%chk=000208424.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208424

0 1
O 1.505448 -1.902573 -0.080964
O -3.051561 -1.418904 -0.074968
N 0.678117 0.266108 0.007339
N -0.782802 -1.671578 -0.079067
N -2.845701 1.501880 0.042320
C 2.076213 0.824633 0.038547
C 2.907985 0.440473 -1.205658
C 2.897627 0.331070 1.250702
C 4.370873 0.538628 -0.737695
C 4.364372 0.469600 0.805544
C -0.452468 1.116976 0.036035
C 0.537489 -1.164015 -0.053428
C -1.716952 0.581325 0.009717
C -1.970899 -0.861189 -0.049314
C -0.223439 2.590090 0.092865
C -0.915584 -3.153240 -0.143066
C -3.668288 1.370011 -1.200276
C -3.680063 1.268587 1.261955
H 2.006649 1.940475 0.088623
H 2.694713 1.093319 -2.063715
H 2.684300 -0.596307 -1.530243
H 2.671705 -0.730289 1.480497
H 2.676999 0.905408 2.161435
H 4.970921 -0.282384 -1.166266
H 4.835112 1.476898 -1.084480
H 4.825705 1.372787 1.238611
H 4.960811 -0.386857 1.164091
H 0.334534 2.893737 0.990011
H -1.189687 3.138375 0.130419
H 0.303622 2.964094 -0.796641
H -0.457356 -3.541707 -1.068156
H -1.986676 -3.431899 -0.128341
H -0.410478 -3.623197 0.717708
H -3.029115 1.542521 -2.079134
H -4.446382 2.148053 -1.189632
H -4.157551 0.387343 -1.315891
H -4.459024 2.044485 1.307394
H -3.049479 1.369055 2.158048
H -4.169189 0.279510 1.292272


%chk=000208424-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208424

0 1
O 1.486832 -2.062248 -0.092950
O -3.145855 -1.434729 -0.076253
N 0.673383 0.151706 0.000872
N -0.816066 -1.732321 -0.085059
N -2.854750 1.442068 0.038093
C 2.079611 0.675819 0.030762
C 2.952348 0.330360 -1.205770
C 2.941003 0.220905 1.239471
C 4.385867 0.723272 -0.743897
C 4.379179 0.650855 0.827506
C -0.432347 1.027772 0.032217
C 0.508518 -1.258184 -0.063318
C -1.734332 0.535172 0.006622
C -1.988438 -0.909883 -0.053141
C -0.194417 2.518522 0.094123
C -0.980508 -3.202043 -0.146021
C -3.669600 1.454514 -1.203404
C -3.674340 1.362989 1.274150
H 1.991060 1.772195 0.079498
H 2.629860 0.876006 -2.110736
H 2.889912 -0.750814 -1.405721
H 2.875782 -0.873584 1.342092
H 2.610266 0.684620 2.186152
H 5.140255 0.046952 -1.181390
H 4.638039 1.746457 -1.078352
H 4.630494 1.638223 1.256744
H 5.128495 -0.064991 1.207003
H 0.356645 2.814658 1.005904
H -1.188084 2.993527 0.105550
H 0.370490 2.886178 -0.782437
H -0.512471 -3.598061 -1.062229
H -2.061085 -3.406047 -0.142835
H -0.490849 -3.673334 0.721736
H -3.009861 1.603993 -2.076194
H -4.375453 2.304707 -1.157104
H -4.247726 0.516940 -1.348416
H -4.381009 2.213626 1.287550
H -3.017946 1.448499 2.158042
H -4.252401 0.417007 1.348335


