%chk=000200488.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200488

0 1
O 1.419274 -1.274922 2.371775
O 1.419285 -1.270278 -2.374418
C 0.873973 -1.534471 -0.001580
C -0.571095 -1.120422 -0.001077
C 1.622120 -0.977059 1.227943
C 1.622046 -0.974564 -1.230013
C 2.665328 -0.034556 0.707555
C 2.665326 -0.033164 -0.707773
C -0.924639 0.211197 -0.000183
C -1.579797 -2.133473 -0.001507
C -2.301431 0.593989 0.000302
C -3.302921 -0.411681 -0.000133
C 3.549974 0.755398 1.421761
C 3.549987 0.758176 -1.420424
C -2.906800 -1.786599 -0.001046
C 4.449937 1.564253 0.698636
C 4.449945 1.565613 -0.695711
C -2.695527 1.970983 0.001219
C -4.681256 -0.025841 0.000353
C -4.024437 2.312040 0.001669
C -5.030681 1.301032 0.001231
H 0.962691 -2.649956 -0.002719
H -0.168163 0.994699 0.000167
H -1.279609 -3.180401 -0.002192
H 3.550106 0.751622 2.512747
H 3.550106 0.756558 -2.511415
H -3.681433 -2.553352 -0.001366
H 5.154403 2.194947 1.242864
H 5.154410 2.197377 -1.238699
H -1.920930 2.736061 0.001548
H -5.441853 -0.805262 0.000014
H -4.333584 3.356295 0.002366
H -6.076354 1.604363 0.001605


%chk=000200488-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200488

0 1
O 1.403338 -1.120916 2.430351
O 1.402231 -1.113929 -2.433001
C 0.872601 -1.430122 -0.001656
C -0.610463 -1.070648 -0.001106
C 1.651246 -0.874696 1.224486
C 1.651175 -0.871813 -1.226518
C 2.756230 -0.009011 0.709453
C 2.756057 -0.007173 -0.709523
C -1.025084 0.267305 -0.000580
C -1.597258 -2.109695 -0.001017
C -2.413582 0.615158 -0.000004
C -3.405596 -0.441456 0.000070
C 3.716885 0.722624 1.439409
C 3.716457 0.726446 -1.437820
C -2.957980 -1.802691 -0.000445
C 4.676507 1.463705 0.713635
C 4.676281 1.465616 -0.710367
C -2.855093 1.980516 0.000499
C -4.796792 -0.092527 0.000637
C -4.216544 2.290527 0.001044
C -5.196373 1.245559 0.001114
H 0.964844 -2.533887 -0.002972
H -0.284765 1.078082 -0.000645
H -1.269858 -3.155694 -0.001400
H 3.706806 0.708153 2.533831
H 3.706116 0.714794 -2.532274
H -3.703651 -2.606410 -0.000390
H 5.434625 2.046000 1.248631
H 5.434245 2.049325 -1.244038
H -2.105318 2.780880 0.000440
H -5.544569 -0.894657 0.000690
H -4.543083 3.336244 0.001420
H -6.261232 1.502995 0.001545


