%chk=000292105.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292105

0 1
O -0.946788 -0.546200 -1.005422
O -2.148374 2.410906 0.616995
O -4.270926 1.163889 0.648756
O -4.093972 -1.761182 -0.423568
O -1.122292 -1.903492 0.854908
O 2.546910 2.084367 0.646051
O 4.228242 -2.072069 0.417395
N 1.602707 0.638257 -0.889654
N 3.559684 0.012382 0.417547
N 3.376394 -1.289016 0.121289
C -2.149727 1.465163 -0.464122
C -0.812653 0.714963 -0.307889
C -3.394478 0.549751 -0.295289
C -3.110860 -0.898399 0.168228
C -1.781349 -1.497117 -0.341706
C 0.353135 1.421508 -1.020291
C 0.027289 -2.757314 0.662334
C 2.514474 0.997094 0.103921
C 4.769836 0.535760 1.110830
H -2.209608 2.011690 -1.430168
H -0.591425 0.522134 0.769568
H -4.005438 0.525154 -1.231009
H -3.169259 -0.976911 1.281585
H -1.896612 -2.308094 -1.090149
H 0.485325 2.449657 -0.596430
H 0.141933 1.529545 -2.110796
H -2.866974 3.074875 0.480063
H -3.779574 1.370481 1.489165
H -4.975052 -1.591284 -0.018157
H 1.528134 -0.332987 -1.212330
H 0.754323 -2.278584 -0.000134
H -0.292370 -3.728521 0.273866
H 0.426689 -2.853987 1.679655
H 5.549561 0.797442 0.376450
H 5.177690 -0.225791 1.798041
H 4.521606 1.442230 1.694966


%chk=000292105-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000292105

0 1
O -0.931795 -0.600017 -0.869578
O -2.609162 2.113620 0.961439
O -4.666195 1.015967 -0.278256
O -4.255998 -1.786079 -0.094755
O -1.256490 -2.092797 1.001582
O 2.764358 2.365486 0.520446
O 4.466876 -1.882909 0.060488
N 1.553762 0.670540 -0.559927
N 3.726555 0.226162 0.274590
N 3.487223 -1.083456 -0.137525
C -2.220074 1.453157 -0.305867
C -0.872981 0.695919 -0.146854
C -3.356535 0.442944 -0.597710
C -3.161724 -0.865709 0.202782
C -1.847208 -1.558670 -0.197770
C 0.323106 1.438849 -0.753144
C -0.146241 -3.029978 0.756846
C 2.641655 1.184554 0.090752
C 4.997516 0.631146 0.896795
H -2.171223 2.203931 -1.120727
H -0.706584 0.499073 0.931549
H -3.382374 0.204717 -1.673333
H -3.126094 -0.625867 1.286616
H -2.022513 -2.338436 -0.962470
H 0.459230 2.426631 -0.278531
H 0.139040 1.593065 -1.834820
H -2.135930 2.973989 1.065479
H -4.518759 1.607197 0.512257
H -5.093443 -1.252586 -0.033589
H 1.559036 -0.316004 -0.836849
H 0.712471 -2.524322 0.276767
H -0.480633 -3.874498 0.122202
H 0.149647 -3.405608 1.747662
H 5.830531 0.477601 0.189210
H 5.190035 0.016073 1.792555
H 4.907118 1.692614 1.166188


