%chk=000191170.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191170

0 1
O 2.186151 0.485883 -0.477692
O 5.154767 -2.181871 -0.394125
O 5.834523 0.701634 -0.159407
O 2.845964 -2.500100 1.525318
O 2.950148 3.458513 -0.613507
O -1.732708 -0.507149 -0.317183
N 0.568886 -1.079977 -0.083666
N -0.877476 -0.120466 1.747689
N -2.200112 0.174975 1.784373
N -5.632322 -0.135039 -1.792278
C 4.379889 -1.212987 0.322263
C 4.590299 0.092439 -0.478150
C 2.915951 -1.721052 0.325031
C 3.461544 1.118014 -0.221274
C 1.865117 -0.585699 0.435706
C 3.503543 2.289464 -1.215202
C -0.578212 -0.534735 0.494645
C -2.741953 -0.048987 0.581176
C -4.084554 0.079391 0.062250
C -5.122879 0.535094 0.895890
C -4.383996 -0.246650 -1.281864
C -6.409534 0.650046 0.368702
C -6.626932 0.307049 -0.976359
H 4.755914 -1.128737 1.367972
H 4.711478 -0.150455 -1.565203
H 2.740297 -2.376102 -0.559832
H 3.474918 1.495386 0.826267
H 1.788258 -0.195723 1.482896
H 2.965887 2.046652 -2.149814
H 4.551920 2.586357 -1.435977
H 0.532735 -1.119409 -1.116684
H 5.293927 -2.980818 0.165103
H 5.917761 0.888123 0.800358
H 1.980070 -2.967472 1.585088
H 1.982979 3.345889 -0.477896
H -4.916877 0.793119 1.939419
H -3.601549 -0.606508 -1.964169
H -7.233256 0.999975 0.989258
H -7.622467 0.382133 -1.432623


%chk=000191170-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191170

0 1
O 2.332715 0.698440 -0.636630
O 5.261395 -2.154987 0.308176
O 5.957393 0.629631 0.252204
O 2.515216 -2.702663 0.982120
O 2.922527 3.478517 -0.844844
O -1.813725 -0.549411 -0.451251
N 0.545144 -0.818631 -0.323381
N -0.769413 0.326024 1.399307
N -2.185618 0.558853 1.518648
N -5.951046 -0.636190 -1.489187
C 4.244311 -1.123077 0.525435
C 4.700832 0.104997 -0.276398
C 2.853999 -1.597144 0.082069
C 3.648270 1.222339 -0.159001
C 1.845121 -0.428653 0.189402
C 3.936848 2.442658 -1.034056
C -0.608406 -0.321333 0.237768
C -2.776404 0.047549 0.438910
C -4.184233 0.025342 0.076477
C -5.146367 0.632628 0.930414
C -4.640378 -0.594487 -1.120777
C -6.502058 0.593447 0.555483
C -6.860622 -0.047805 -0.655620
H 4.193151 -0.857628 1.604399
H 4.815527 -0.195904 -1.341189
H 2.897500 -1.939270 -0.976041
H 3.548965 1.537851 0.900881
H 1.723317 -0.113626 1.244793
H 3.997509 2.124931 -2.097497
H 4.896938 2.888927 -0.733884
H 0.495844 -1.111972 -1.302714
H 4.988279 -2.966974 0.806888
H 6.589073 -0.132762 0.322369
H 1.607765 -3.037461 0.766861
H 2.035261 3.052081 -0.970293
H -4.817791 1.116049 1.855594
H -3.930889 -1.072155 -1.804489
H -7.271798 1.049761 1.184896
H -7.906056 -0.097690 -0.979343


