%chk=000207344.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207344

0 1
I -0.045023 -0.551599 -2.967794
I 4.596139 0.712911 2.168452
I 3.404998 -0.417555 -3.730793
I 5.738612 0.240533 -1.174086
O -0.179351 0.211851 1.906537
O 1.528029 0.623846 3.290530
O -2.816835 -5.074667 0.003012
O -3.853773 4.453615 -0.545258
C -0.457778 0.044557 0.444935
C 0.949551 0.050127 -0.162641
C -1.123289 -1.303002 0.310926
C -1.316334 1.240114 0.113893
C 1.898993 0.287144 0.862154
C 1.173517 0.416598 2.168929
C 1.375345 -0.159823 -1.463954
C 3.253973 0.342804 0.588850
C -2.246243 -1.476121 -0.511633
C -2.513897 1.396945 0.846735
C -0.603750 -2.401466 1.023865
C -0.951986 2.205613 -0.831582
C 2.751276 -0.107976 -1.745609
C 3.680364 0.146601 -0.736219
C -2.845826 -2.729772 -0.642884
C -3.354336 2.476961 0.614780
C -1.181796 -3.660144 0.911377
C -1.781805 3.300796 -1.086417
C -2.299836 -3.806808 0.070559
C -2.974505 3.418538 -0.360249
H -2.665636 -0.625496 -1.056340
H -2.769896 0.658304 1.613245
H 0.256847 -2.259837 1.681943
H -0.014204 2.125053 -1.385125
H -3.712575 -2.861110 -1.281431
H -4.280692 2.616436 1.168727
H -0.796450 -4.521317 1.453717
H -1.498533 4.041828 -1.826709
H -3.602695 -5.129531 -0.595599
H -3.536201 5.100949 -1.223345


%chk=000207344-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207344

0 1
I -0.058918 -0.615312 -3.007652
I 4.580450 0.871465 2.240128
I 3.476061 -0.424243 -3.765735
I 5.820751 0.372669 -1.142418
O -0.217136 0.185280 1.933306
O 1.573026 0.677000 3.318484
O -2.843137 -5.248271 0.067639
O -3.781702 4.638951 -0.584556
C -0.491586 0.011648 0.426425
C 0.937381 0.039140 -0.157381
C -1.164553 -1.361942 0.295637
C -1.347394 1.227953 0.063312
C 1.870865 0.315599 0.870171
C 1.144237 0.433465 2.178715
C 1.382994 -0.169750 -1.479434
C 3.257293 0.419376 0.618356
C -2.396719 -1.552695 -0.370805
C -2.608709 1.384959 0.702850
C -0.520680 -2.494180 0.864029
C -0.889372 2.263564 -0.783390
C 2.782716 -0.086948 -1.760359
C 3.718678 0.217715 -0.716245
C -2.981519 -2.832672 -0.463065
C -3.402849 2.520628 0.476556
C -1.088541 -3.775537 0.779151
C -1.677900 3.408488 -1.023798
C -2.326490 -3.945495 0.114754
C -2.939453 3.533543 -0.396785
H -2.900086 -0.702798 -0.839940
H -2.953681 0.621138 1.406703
H 0.430220 -2.373986 1.394311
H 0.089682 2.194112 -1.266222
H -3.937522 -2.959797 -0.987096
H -4.368613 2.649343 0.973216
H -0.599773 -4.648218 1.221252
H -1.306364 4.197056 -1.690623
H -3.710621 -5.271156 -0.407674
H -3.366637 5.305807 -1.186320


