%chk=000186439.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186439

0 1
O 2.481510 2.357283 -1.084466
O 2.484356 2.355609 1.084042
O 4.071707 -0.813267 1.083787
O 4.072214 -0.809315 -1.083622
N 2.202334 1.889090 -0.000209
N 3.528958 -0.748998 0.000069
C -0.776122 -0.480657 -0.000073
C -0.012128 0.718830 -0.000116
C -2.233360 -0.400009 -0.000048
C 1.402224 0.614526 -0.000122
C -2.858267 0.868804 -0.000082
C -0.108604 -1.726730 -0.000059
C 1.277180 -1.820644 -0.000015
C 2.035999 -0.618603 -0.000034
C -0.691677 1.998371 -0.000179
C -2.045349 2.067461 -0.000161
C -3.048982 -1.562693 0.000013
C -4.274983 0.957830 -0.000049
C 1.962824 -3.141900 0.000048
C -4.426857 -1.459259 0.000045
C -5.046314 -0.188398 0.000014
H -0.706110 -2.644403 -0.000060
H -0.094685 2.912676 -0.000293
H -2.558931 3.031370 -0.000217
H -2.576267 -2.546643 0.000034
H -4.746049 1.940917 -0.000077
H 2.605578 -3.270676 -0.888135
H 2.606979 -3.269915 0.887339
H 1.262439 -3.989403 0.000992
H -5.047988 -2.354930 0.000094
H -6.134626 -0.124521 0.000040


%chk=000186439-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186439

0 1
O 2.040624 2.746402 -0.916411
O 3.093587 1.963222 0.953138
O 4.127952 -1.407960 0.869735
O 4.132327 -0.053315 -0.969770
N 2.242636 1.855951 -0.008739
N 3.537508 -0.689573 -0.020061
C -0.781809 -0.485765 -0.013247
C -0.012861 0.739491 -0.054355
C -2.246233 -0.415739 -0.010224
C 1.411098 0.622361 -0.042648
C -2.883614 0.876887 -0.033403
C -0.088178 -1.729279 0.032347
C 1.312655 -1.840947 0.055344
C 2.053542 -0.623719 0.024273
C -0.693875 2.015908 -0.074779
C -2.072397 2.071478 -0.059824
C -3.080609 -1.575652 0.016533
C -4.308754 0.968386 -0.027758
C 1.979330 -3.201222 0.087124
C -4.477869 -1.465746 0.020892
C -5.100825 -0.185182 -0.000838
H -0.658366 -2.661657 0.047217
H -0.111232 2.938116 -0.120079
H -2.578792 3.043197 -0.076560
H -2.638358 -2.576000 0.032643
H -4.774329 1.960410 -0.045707
H 2.740479 -3.308460 -0.706810
H 2.500887 -3.363999 1.045739
H 1.229967 -3.997599 -0.048597
H -5.094461 -2.370569 0.040410
H -6.193030 -0.107625 0.002914


