%chk=000182981.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182981

0 1
I -6.796454 -0.641209 0.022253
O -0.137408 1.629949 -0.021067
O 0.098787 -0.347663 1.162173
O 0.094104 -0.377927 -1.153125
C 2.048386 0.534933 -0.011154
C 3.562494 0.753316 -0.017044
C 1.293064 1.887321 -0.027943
C 1.546256 -0.222686 1.238965
C 1.541378 -0.256177 -1.238349
C -0.469584 0.243569 -0.002253
C 4.375971 -0.547258 -0.001783
C -1.959107 0.046021 0.003363
C 5.884360 -0.257924 -0.007336
C -2.816465 1.154389 -0.008848
C -2.473694 -1.257619 0.020935
C 6.702077 -1.546716 0.008203
C -4.201335 0.957661 -0.003440
C -3.858982 -1.454927 0.026353
C -4.698800 -0.343746 0.014069
H 3.846778 1.375191 0.857147
H 3.843257 1.352229 -0.908232
H 1.477685 2.500994 0.869268
H 1.473561 2.476159 -0.942469
H 1.918704 -1.258495 1.301931
H 1.740464 0.314191 2.181873
H 1.732496 0.254625 -2.196248
H 1.913035 -1.293558 -1.274280
H 4.118011 -1.152106 0.889191
H 4.115780 -1.174183 -0.876703
H 6.153817 0.365070 0.868304
H 6.151631 0.342377 -0.899346
H -2.398106 2.165050 -0.022521
H -1.791104 -2.110175 0.030268
H 6.491535 -2.172467 -0.866862
H 6.493744 -2.149771 0.899581
H 7.777417 -1.332787 0.004112
H -4.872301 1.817973 -0.012906
H -4.263451 -2.468124 0.040022


%chk=000182981-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182981

0 1
I -6.926081 -0.638071 0.020037
O -0.174613 1.678075 -0.021679
O 0.039115 -0.372543 1.205811
O 0.035112 -0.405771 -1.192492
C 2.024733 0.499976 -0.008989
C 3.558218 0.714118 -0.014336
C 1.301601 1.872503 -0.028215
C 1.527505 -0.254008 1.248537
C 1.523632 -0.291723 -1.241573
C -0.508762 0.258398 -0.001386
C 4.427118 -0.567217 -0.002918
C -2.008567 0.079543 0.003246
C 5.939500 -0.245835 -0.006712
C -2.882968 1.186792 -0.011238
C -2.533184 -1.232844 0.022242
C 6.817791 -1.514978 0.003071
C -4.282491 0.990111 -0.006668
C -3.928926 -1.444600 0.027020
C -4.791038 -0.326142 0.012530
H 3.827278 1.335006 0.866040
H 3.823716 1.316350 -0.908682
H 1.565103 2.470879 0.865162
H 1.560865 2.443610 -0.940504
H 1.934939 -1.280019 1.298503
H 1.796370 0.292402 2.173197
H 1.791796 0.224607 -2.183555
H 1.929060 -1.319603 -1.259849
H 4.194795 -1.179930 0.891238
H 4.193689 -1.195993 -0.885526
H 6.181772 0.381114 0.875668
H 6.180399 0.366376 -0.899755
H -2.467886 2.197692 -0.026102
H -1.851181 -2.087983 0.033319
H 6.616629 -2.143932 -0.884682
H 6.618449 -2.129033 0.901624
H 7.893309 -1.260728 -0.000102
H -4.957781 1.850109 -0.017910
H -4.331014 -2.461205 0.041728


