%chk=000202648.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202648

0 1
I -1.396924 -2.971040 0.881397
I -0.595961 2.077402 -2.508120
I -5.576153 1.531138 0.596782
O 2.489252 -2.096771 1.401474
O 2.110776 -2.954893 -0.626156
O 4.602683 2.350228 1.581758
O 4.660851 1.864967 -0.600622
N -4.110728 -1.300945 1.464067
C 1.170146 -0.735207 -0.028426
C 0.107928 -0.909019 -1.131534
C 2.154446 0.400271 -0.355431
C -1.227218 -0.369454 -0.704341
C 2.986848 0.803641 0.863232
C 1.931338 -2.039151 0.137734
C -2.045262 -1.092035 0.173378
C -1.687646 0.869886 -1.176763
C -3.313659 -0.599081 0.591452
C 4.131061 1.683383 0.469207
C -2.929353 1.380462 -0.788689
C -3.733080 0.663604 0.082899
H 0.666430 -0.506650 0.952571
H 0.010255 -1.986360 -1.424143
H 0.453593 -0.435960 -2.081607
H 2.819487 0.114423 -1.199601
H 1.583859 1.283584 -0.726589
H 3.386732 -0.098208 1.393508
H 2.358179 1.311210 1.629066
H -3.267335 2.352020 -1.175704
H 2.996371 -2.936858 1.558390
H -5.022076 -0.949361 1.733229
H -3.837107 -2.213280 1.809797
H 5.376166 2.939655 1.377484


%chk=000202648-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000202648

0 1
I -1.643800 -2.703920 1.553592
I -0.370673 1.134870 -3.254521
I -5.143503 2.236445 0.290325
O 2.930145 -2.791139 0.705452
O 2.925500 -2.254781 -1.552470
O 4.428397 2.282885 1.750306
O 2.544409 3.036487 0.622859
N -4.005028 -0.495879 1.754310
C 1.302216 -1.152549 -0.037221
C 0.107109 -1.435930 -1.008635
C 1.796134 0.319756 -0.094523
C -1.130753 -0.604481 -0.716311
C 2.915338 0.601911 0.927577
C 2.440858 -2.093037 -0.410600
C -2.010406 -0.922440 0.356917
C -1.485182 0.530784 -1.503126
C -3.175206 -0.159490 0.703474
C 3.227835 2.080899 1.049217
C -2.617569 1.318352 -1.203358
C -3.436145 0.983995 -0.116317
H 1.002378 -1.389396 0.998599
H -0.147045 -2.510034 -0.934735
H 0.453936 -1.256925 -2.039846
H 2.147912 0.553352 -1.115501
H 0.942584 0.990285 0.107973
H 3.852126 0.070287 0.680070
H 2.625844 0.241243 1.935704
H -2.857531 2.187996 -1.817707
H 3.677139 -3.385961 0.418316
H -4.825420 0.072204 1.956973
H -3.812558 -1.315300 2.326621
H 4.594859 3.261110 1.836286


