%chk=000219264.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219264

0 1
O 2.831703 -0.982602 -0.780248
O 0.546320 1.606582 -1.267020
O -2.394446 1.397733 -0.736806
O 1.692550 -0.951644 1.182917
N -1.865614 -0.851936 -0.541255
C 0.510808 -0.815392 -0.956040
C -0.653933 -1.716180 -0.481661
C -0.061090 0.610045 -1.025760
C -1.586714 0.501184 -0.733009
C -3.150760 -1.341841 0.010740
C 1.696814 -0.907481 -0.023091
C -3.160835 -1.377748 1.535771
C 4.127203 -0.980346 -0.087231
C 4.446931 0.419129 0.387289
H 0.835527 -1.099876 -1.994322
H -0.787552 -2.593650 -1.148381
H -0.481047 -2.095266 0.552558
H -3.954985 -0.659577 -0.363052
H -3.350459 -2.351809 -0.411318
H -2.400625 -2.051616 1.946440
H -2.976291 -0.382268 1.964293
H -4.135084 -1.712784 1.912948
H 4.083541 -1.715582 0.735132
H 4.788701 -1.331248 -0.900901
H 5.484902 0.501383 0.731473
H 4.301623 1.160062 -0.412051
H 3.797814 0.720930 1.223383


%chk=000219264-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219264

0 1
O 2.894645 -0.936314 -0.871756
O 0.716849 1.508685 -1.155589
O -2.280603 1.478016 -0.775611
O 1.846983 -1.320623 1.184211
N -1.829406 -0.814315 -0.366896
C 0.514664 -0.976358 -0.863225
C -0.687607 -1.750429 -0.272142
C 0.023655 0.500987 -0.936068
C -1.499449 0.492543 -0.693319
C -3.201342 -1.220359 -0.027118
C 1.793952 -1.111632 -0.050941
C -3.404582 -1.458802 1.485645
C 4.235288 -0.863457 -0.199577
C 4.504677 0.559185 0.294856
H 0.728153 -1.279224 -1.904773
H -0.907934 -2.675828 -0.834863
H -0.479738 -2.017343 0.780900
H -3.861214 -0.406393 -0.375979
H -3.449180 -2.137188 -0.597601
H -2.756283 -2.268327 1.866151
H -3.188888 -0.539696 2.056601
H -4.453356 -1.746850 1.678741
H 4.250364 -1.595051 0.627433
H 4.933192 -1.169006 -0.994748
H 5.532057 0.621331 0.699012
H 4.408722 1.285796 -0.529224
H 3.801382 0.838854 1.096680


