%chk=000226175.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226175

0 1
O 1.648944 -0.646812 1.489462
O -1.649004 -0.647348 -1.489624
O 4.518798 -2.352738 -1.160300
O -4.518930 -2.352794 1.160103
O 3.711626 -2.435733 0.923866
O -3.711887 -2.435634 -0.924121
C 1.480038 -0.700676 0.070344
C -1.480097 -0.700837 -0.070492
C 0.705451 0.575828 -0.296320
C 0.694778 -1.973596 -0.320229
C -0.705634 0.575830 0.295863
C -0.694714 -1.973589 0.320384
C 2.881974 -0.720114 -0.642488
C -2.882030 -0.720221 0.642350
C 3.689846 0.544514 -0.449131
C -3.689836 0.544471 0.449109
C 3.707380 -1.888561 -0.158283
C -3.707519 -1.888591 0.158093
C 4.275160 1.157930 -1.567690
C -4.275094 1.157812 1.567739
C 3.873513 1.099841 0.825257
C -3.873504 1.099938 -0.825221
C 5.035150 2.319720 -1.408207
C -5.035024 2.319659 1.408390
C 4.634709 2.261009 0.978039
C -4.634638 2.261164 -0.977869
C 5.217051 2.872771 -0.136643
C -5.216923 2.872847 0.136886
H 0.642936 0.667169 -1.400159
H 1.256493 1.466360 0.070041
H 1.242413 -2.884402 -0.013669
H 0.587230 -2.021349 -1.423458
H -0.643126 0.667441 1.399680
H -1.256766 1.466217 -0.070709
H -1.242256 -2.884523 0.014036
H -0.587162 -2.021069 1.423624
H 2.690368 -0.857679 -1.744075
H -2.690407 -0.857852 1.743925
H 2.143605 -1.440323 1.824173
H -2.143551 -1.441021 -1.824115
H 4.145669 0.730585 -2.560788
H -4.145606 0.730360 2.560791
H 3.403533 0.629395 1.695599
H -3.403570 0.629562 -1.695625
H 5.105311 -3.103916 -0.866870
H -5.105519 -3.103897 0.866629
H 5.487618 2.793777 -2.277851
H -5.487446 2.793653 2.278091
H 4.773437 2.689323 1.969852
H -4.773362 2.689586 -1.969636
H 5.810497 3.776994 -0.015009
H -5.810319 3.777117 0.015355


%chk=000226175-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226175

0 1
O 1.622581 -0.675696 1.597732
O -1.622525 -0.676834 -1.598348
O 4.556753 -2.452211 -1.060763
O -4.557596 -2.451505 1.060864
O 3.763525 -2.381703 1.108108
O -3.765449 -2.381226 -1.108358
C 1.501738 -0.722402 0.125350
C -1.501595 -0.722847 -0.125956
C 0.718417 0.540617 -0.282155
C 0.711936 -1.992653 -0.297758
C -0.718560 0.540577 0.280909
C -0.711411 -1.992709 0.297698
C 2.923838 -0.735563 -0.560948
C -2.923633 -0.736004 0.560603
C 3.750170 0.550818 -0.402143
C -3.749959 0.550443 0.402149
C 3.753758 -1.912452 -0.061452
C -3.753758 -1.912963 0.061584
C 4.179103 1.245279 -1.561064
C -4.178017 1.245095 1.561279
C 4.106436 1.057820 0.874856
C -4.107194 1.057259 -0.874656
C 4.941850 2.429396 -1.452558
C -4.940747 2.429260 1.453174
C 4.869409 2.241562 0.982346
C -4.870179 2.241034 -0.981746
C 5.291190 2.931360 -0.178027
C -5.291005 2.931063 0.178835
H 0.674887 0.593163 -1.385879
H 1.256243 1.432935 0.082307
H 1.249760 -2.903594 0.031013
H 0.638992 -2.018913 -1.401789
H -0.675036 0.593679 1.384607
H -1.256583 1.432600 -0.083983
H -1.248954 -2.903963 -0.030656
H -0.638449 -2.018466 1.401741
H 2.766662 -0.897193 -1.642331
H -2.766160 -0.897585 1.641947
H 2.238775 -1.416473 1.863724
H -2.238379 -1.418031 -1.863976
H 3.915134 0.857416 -2.552451
H -3.913362 0.857349 2.552530
H 3.763173 0.541514 1.775894
H -3.764685 0.540801 -1.775887
H 5.118525 -3.182403 -0.680379
H -5.120476 -3.180840 0.680471
H 5.262540 2.956059 -2.358344
H -5.260728 2.956073 2.359125
H 5.133824 2.626628 1.973719
H -5.135348 2.625947 -1.972977
H 5.884964 3.848178 -0.090255
H -5.884789 3.847904 0.091373


