%chk=000297984.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297984

0 1
O 3.528116 -0.169075 1.003104
O 2.735097 1.907873 0.398840
O 1.158839 -0.428848 -1.153612
O -0.571136 0.865485 -0.274728
O -0.251170 -2.656161 -0.746221
C 2.100672 -0.286363 1.051425
C 1.569724 1.118117 0.638851
C 1.594205 -1.259852 -0.035321
C 0.793824 0.880033 -0.680901
C 3.910973 1.046555 0.294850
C 0.371061 -2.077067 0.406664
C 4.204838 0.738768 -1.157388
C 5.024359 1.697284 1.083566
C -1.513237 0.393320 -1.282219
C -2.774123 0.114090 -0.511937
C -3.110913 -1.202035 -0.163660
C -3.613359 1.174062 -0.138841
C -4.292115 -1.454744 0.538825
C -4.791774 0.915157 0.566592
C -5.134093 -0.398623 0.902690
H 1.873770 -0.600173 2.086258
H 0.977262 1.664213 1.397586
H 2.401074 -1.884979 -0.472410
H 0.984217 1.563693 -1.522827
H -0.380410 -1.443381 0.921322
H 0.639300 -2.946431 1.032281
H 4.387096 1.655235 -1.731315
H 5.084256 0.091200 -1.258210
H 3.361542 0.216109 -1.637574
H 5.810791 0.969280 1.324695
H 5.478980 2.531079 0.535712
H 4.647134 2.097091 2.036703
H -1.093800 -0.516240 -1.764485
H -1.632383 1.193931 -2.033122
H -0.314527 -1.958609 -1.459879
H -2.450248 -2.032127 -0.432582
H -3.341174 2.198173 -0.390068
H -4.554896 -2.477545 0.804819
H -5.442618 1.738409 0.855946
H -6.053755 -0.598905 1.449371


%chk=000297984-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297984

0 1
O 3.744923 -0.225855 0.972210
O 2.836958 1.881078 0.438954
O 1.187486 -0.487799 -1.095485
O -0.589265 0.751908 0.007879
O -0.168809 -2.861984 -0.564366
C 2.286686 -0.388383 1.067747
C 1.686778 1.020082 0.728923
C 1.696544 -1.358075 0.018848
C 0.769928 0.796721 -0.494631
C 4.044931 1.029816 0.231484
C 0.531152 -2.215134 0.551240
C 4.265573 0.750630 -1.262808
C 5.224081 1.713070 0.917425
C -1.618290 0.696849 -1.075200
C -2.941712 0.295951 -0.466293
C -3.177877 -1.053039 -0.091961
C -3.962272 1.257838 -0.268050
C -4.416345 -1.426749 0.473429
C -5.203787 0.883549 0.295015
C -5.433036 -0.460895 0.666482
H 2.074554 -0.715216 2.099120
H 1.120017 1.482315 1.550650
H 2.477222 -1.991084 -0.433840
H 0.897321 1.557135 -1.287576
H -0.170686 -1.585115 1.134321
H 0.915471 -3.029114 1.190205
H 4.449822 1.700206 -1.795008
H 5.145436 0.096702 -1.393161
H 3.385185 0.257836 -1.708105
H 6.123966 1.079324 0.842653
H 5.431666 2.683245 0.435116
H 4.989986 1.882098 1.980308
H -1.286451 -0.038703 -1.834280
H -1.677107 1.697914 -1.548277
H -0.166813 -2.203802 -1.310901
H -2.394147 -1.808316 -0.238228
H -3.784087 2.302543 -0.551712
H -4.590970 -2.470372 0.757953
H -5.987237 1.635380 0.441885
H -6.395397 -0.754559 1.100832


