%chk=000278926.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278926

0 1
O 1.701484 1.858310 0.035494
O -3.676043 -1.679977 -0.075256
O 4.143664 2.438178 0.088129
O -5.472870 0.112400 -0.119013
O 5.704540 0.832211 0.126306
O -4.929867 2.282615 -0.111147
N -0.836964 1.275014 -0.019159
N 2.697568 -2.110295 0.066347
C 0.971802 -0.387279 0.024465
C -0.423018 -0.070970 -0.007003
C -1.392842 -1.090377 -0.026101
C 1.324062 -1.750033 0.035275
C -0.985102 -2.440597 -0.014063
C 0.357021 -2.781655 0.016284
C 2.006501 0.673988 0.044911
C -2.855583 -0.788705 -0.059063
C 3.392743 0.192342 0.076589
C -3.167735 0.651444 -0.069103
C -2.180714 1.603360 -0.049489
C 3.689160 -1.147021 0.086096
C 4.524305 1.129092 0.099511
C -4.555719 1.123554 -0.100658
H -1.764164 -3.217139 -0.029490
H 0.653967 -3.827931 0.025183
H -0.095869 2.026038 -0.004520
H 2.946705 -3.101181 0.073915
H -2.423939 2.683575 -0.057269
H 4.737828 -1.501174 0.110042
H 4.933421 3.053461 0.104196
H -6.408743 0.463148 -0.140310


%chk=000278926-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000278926

0 1
O 1.604789 1.943956 0.033321
O -3.720940 -1.830056 -0.073945
O 4.296038 2.515378 0.090649
O -5.624105 0.200420 -0.124409
O 5.762448 0.725699 0.128128
O -4.857959 2.382979 -0.111076
N -0.886791 1.220762 -0.018695
N 2.718329 -2.056891 0.065900
C 0.963459 -0.384404 0.024395
C -0.448079 -0.103872 -0.006653
C -1.415743 -1.144090 -0.025551
C 1.346905 -1.754692 0.035495
C -0.970652 -2.494059 -0.013094
C 0.389584 -2.808165 0.016967
C 1.974998 0.709591 0.043930
C -2.892459 -0.863542 -0.058294
C 3.379612 0.272067 0.075843
C -3.232107 0.576561 -0.069615
C -2.214379 1.533134 -0.048918
C 3.681361 -1.089307 0.085097
C 4.575809 1.157172 0.100497
C -4.604104 1.144987 -0.102580
H -1.743927 -3.269326 -0.028187
H 0.723767 -3.852003 0.026388
H -0.106142 1.923912 -0.002664
H 2.994859 -3.040921 0.073886
H -2.477472 2.595102 -0.057216
H 4.727948 -1.407279 0.108659
H 5.162322 3.009434 0.108821
H -6.491769 0.691850 -0.145979


