%chk=000179163.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179163

0 1
O -1.800534 -1.767781 1.140451
O -2.916955 -1.385198 -0.788753
O 2.506126 0.079427 -0.859637
C -3.779796 1.337470 0.465965
C -2.463511 1.440197 1.259172
C -3.197826 0.094045 1.141831
C -3.428468 1.581759 -1.002005
C -1.404100 1.747224 0.255348
C -1.926867 1.839055 -0.985797
C -2.662528 -1.034864 0.338805
C -1.207807 2.116939 -2.247939
C -1.193017 -2.957251 0.568564
C 0.159055 -2.663914 -0.023990
C 0.667465 -1.362906 -0.079631
C 0.906218 -3.741448 -0.529380
C 1.929532 -1.174001 -0.651771
C 2.163771 -3.517866 -1.098373
C 2.697027 -2.229841 -1.164906
C 2.257272 1.123359 0.030969
C 2.092681 0.945508 1.408892
C 2.288047 2.391703 -0.570144
C 1.947680 2.085265 2.204894
C 2.145728 3.510825 0.250391
C 1.970480 3.361342 1.632263
H -4.733303 1.722878 0.812792
H -2.370646 1.893110 2.242939
H -3.694290 -0.273259 2.055013
H -3.985131 2.436401 -1.418996
H -3.671552 0.698066 -1.629701
H -0.381138 1.897010 0.554319
H -1.221753 1.235625 -2.910036
H -0.150590 2.370687 -2.078414
H -1.661662 2.947786 -2.805135
H -1.878547 -3.393258 -0.188452
H -1.120908 -3.620169 1.454056
H 0.082250 -0.524196 0.302358
H 0.508230 -4.752352 -0.486636
H 2.736467 -4.357938 -1.492576
H 3.671978 -2.032684 -1.603511
H 2.086731 -0.049148 1.849495
H 2.432596 2.480206 -1.644089
H 1.818936 1.974211 3.281718
H 2.168364 4.508004 -0.189224
H 1.855398 4.241072 2.261462


%chk=000179163-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179163

0 1
O -1.843769 -2.097759 0.451549
O -2.178179 -0.533666 -1.261528
O 3.209205 -0.388945 -0.511004
C -4.066468 0.995310 0.749718
C -2.719034 1.349781 1.391083
C -3.062128 -0.152547 1.006463
C -4.101262 1.693127 -0.620905
C -1.993297 2.186918 0.386807
C -2.736106 2.375782 -0.743589
C -2.350410 -0.881867 -0.065808
C -2.312136 3.062695 -2.012478
C -1.094458 -2.966007 -0.510353
C 0.400451 -2.874516 -0.282944
C 1.070094 -1.638210 -0.460784
C 1.141865 -4.027656 0.074894
C 2.466032 -1.573633 -0.266619
C 2.543875 -3.950614 0.240593
C 3.215496 -2.721284 0.074223
C 2.773237 0.861848 -0.006443
C 2.001405 0.995328 1.171708
C 3.239116 1.998306 -0.705164
C 1.693119 2.291242 1.643290
C 2.923205 3.285403 -0.220118
C 2.147808 3.439843 0.954228
H -4.985988 0.954017 1.340186
H -2.595535 1.522933 2.464307
H -3.278096 -0.780854 1.875287
H -4.926161 2.433134 -0.655954
H -4.257511 0.985716 -1.457013
H -0.968921 2.540545 0.533045
H -2.226792 2.324744 -2.834189
H -1.333557 3.560268 -1.900708
H -3.054931 3.819177 -2.333425
H -1.367179 -2.645817 -1.532865
H -1.467057 -3.984344 -0.315639
H 0.508998 -0.746640 -0.761261
H 0.624426 -4.983095 0.219810
H 3.114135 -4.846430 0.508836
H 4.298399 -2.632840 0.200990
H 1.655890 0.109451 1.713171
H 3.839514 1.855482 -1.608594
H 1.103658 2.398973 2.561073
H 3.283622 4.167728 -0.760434
H 1.906527 4.440073 1.329154


