%chk=000180429.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180429

0 1
O -1.571752 -0.349837 -1.605808
O 0.467221 -3.094496 0.209143
O 3.242334 2.591734 -0.107211
C -2.005177 -0.461553 -0.226879
C -1.236335 0.732347 0.443228
C -3.575010 -0.355206 -0.234820
C -1.742943 2.045215 -0.196367
C -3.973113 1.030876 -0.798173
C -3.263927 2.189725 -0.092818
C -1.510239 -1.802608 0.333814
C 0.266138 0.540907 0.208943
C -1.403878 0.772501 1.971554
C -4.152050 -1.438047 -1.173700
C -4.182136 -0.566785 1.159101
C 0.823761 -0.755586 0.152664
C -0.009767 -1.975098 0.223497
C 1.116283 1.647045 0.127805
C 2.211558 -0.928616 -0.006176
C 2.493919 1.445333 -0.031304
C 3.075516 0.159614 -0.100335
C 4.568910 -0.006565 -0.272812
C 4.890025 -0.726069 -1.586965
C 5.180777 -0.733356 0.929511
H -1.442568 2.048427 -1.267820
H -1.248770 2.917033 0.270744
H -5.068127 1.161224 -0.735971
H -3.717646 1.060017 -1.878611
H -3.576792 2.249041 0.966644
H -3.575087 3.148566 -0.551728
H -2.008673 -2.656153 -0.171091
H -1.800256 -1.908857 1.400452
H -2.461471 0.873858 2.259646
H -1.009346 -0.127472 2.455392
H -0.868264 1.629520 2.398887
H -3.947115 -2.449484 -0.807690
H -5.240711 -1.344020 -1.257652
H -3.745709 -1.354524 -2.188454
H -3.945851 -1.554005 1.567666
H -3.825760 0.187480 1.877098
H -5.274673 -0.484885 1.127250
H -1.811383 -1.145430 -2.117873
H 0.739882 2.667637 0.178076
H 2.607654 -1.950181 -0.054448
H 5.031827 1.023870 -0.323405
H 4.219156 2.380935 -0.226249
H 4.518610 -1.758121 -1.585587
H 5.969112 -0.769826 -1.766783
H 4.425629 -0.221529 -2.442361
H 4.930393 -0.230558 1.870575
H 6.272030 -0.783068 0.854175
H 4.813992 -1.763971 1.009626


%chk=000180429-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180429

0 1
O -1.584413 -0.325200 -1.671289
O 0.510532 -3.146478 0.193854
O 3.248769 2.678116 -0.227405
C -2.025339 -0.456675 -0.245907
C -1.251632 0.739224 0.447442
C -3.613804 -0.358411 -0.239005
C -1.786618 2.087862 -0.122381
C -4.027638 1.056573 -0.747082
C -3.322015 2.214513 -0.013531
C -1.509469 -1.807949 0.292076
C 0.256607 0.551510 0.162255
C -1.362752 0.763937 2.008045
C -4.217020 -1.398660 -1.230289
C -4.256383 -0.649052 1.147305
C 0.842030 -0.753720 0.126179
C 0.010090 -1.977723 0.200402
C 1.118577 1.655177 0.038608
C 2.243096 -0.902871 -0.025519
C 2.514591 1.486129 -0.114528
C 3.117439 0.192641 -0.146843
C 4.628525 -0.020849 -0.293400
C 4.968679 -0.879493 -1.540324
C 5.232744 -0.639975 0.996160
H -1.490157 2.163124 -1.184924
H -1.314677 2.930356 0.418686
H -5.128100 1.156159 -0.657532
H -3.777496 1.122009 -1.823608
H -3.635407 2.251507 1.048545
H -3.637134 3.177917 -0.459020
H -1.963342 -2.661020 -0.246236
H -1.791245 -1.940590 1.353834
H -2.366416 1.049225 2.358921
H -1.097538 -0.203941 2.467532
H -0.651198 1.514087 2.397542
H -4.004912 -2.443504 -0.936808
H -5.316701 -1.285199 -1.248592
H -3.860846 -1.236659 -2.263745
H -3.974808 -1.646825 1.530155
H -3.998570 0.094433 1.916772
H -5.357640 -0.640023 1.041070
H -1.734242 -1.190361 -2.128430
H 0.742501 2.680778 0.047791
H 2.627777 -1.929104 -0.050815
H 5.135423 0.960257 -0.442788
H 4.213095 2.485640 -0.347825
H 4.532739 -1.890791 -1.450895
H 6.063356 -0.991545 -1.648342
H 4.570156 -0.421782 -2.463162
H 5.032080 -0.006271 1.878568
H 6.326801 -0.764711 0.895486
H 4.792104 -1.634793 1.189397


