%chk=000236483.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236483

0 1
O 6.784105 0.803616 0.247841
O -6.753889 -0.746177 -0.185057
O -5.925692 1.322662 -0.004185
C 1.849253 0.467762 -0.052176
C 0.620302 -0.404809 0.236592
C -0.682465 0.348947 -0.062584
C 3.152851 -0.284420 0.248774
C -1.912128 -0.523409 0.224453
C 4.379333 0.585204 -0.044410
C -3.209979 0.236667 -0.072192
C 5.692314 -0.146866 0.281443
C -4.439318 -0.635563 0.204926
C 6.092149 -1.186867 -0.756341
C -5.707284 0.135495 0.003865
H 1.801800 1.396322 0.549029
H 1.839280 0.794528 -1.110287
H 0.666632 -1.331647 -0.367427
H 0.631504 -0.732860 1.294033
H -0.728405 1.276104 0.541633
H -0.692136 0.678981 -1.119750
H 3.197933 -1.212565 -0.354529
H 3.162923 -0.609923 1.307290
H -1.866291 -1.448538 -0.382634
H -1.898830 -0.854200 1.281307
H 4.383725 0.901887 -1.106070
H 4.326127 1.525990 0.536232
H -3.221351 0.578685 -1.126771
H -3.263008 1.162844 0.538006
H 5.664305 -0.583264 1.305466
H -4.419482 -1.025769 1.247484
H -4.438317 -1.542576 -0.439759
H 6.222986 -0.727191 -1.745279
H 7.058180 -1.640207 -0.496893
H 5.347032 -1.982467 -0.843740
H 6.629703 1.535855 0.868385
H -7.625961 -0.287828 -0.310575


%chk=000236483-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236483

0 1
O 6.922986 0.847482 0.158515
O -6.909972 -0.785454 0.087479
O -5.977525 1.309759 -0.270373
C 1.880057 0.480203 -0.038595
C 0.628839 -0.400155 0.177454
C -0.697480 0.359911 -0.046897
C 3.206146 -0.282168 0.180448
C -1.949288 -0.520442 0.165756
C 4.454652 0.602119 -0.040554
C -3.269215 0.249138 -0.058007
C 5.790534 -0.099598 0.292548
C -4.505982 -0.646093 0.145561
C 6.134116 -1.262879 -0.643721
C -5.817163 0.091688 -0.039110
H 1.838942 1.350772 0.649305
H 1.862308 0.896882 -1.067253
H 0.671915 -1.272443 -0.508164
H 0.645303 -0.813904 1.207681
H -0.741682 1.231418 0.639208
H -0.712402 0.774808 -1.076278
H 3.239323 -1.153139 -0.504493
H 3.222837 -0.694521 1.211863
H -1.904292 -1.390488 -0.522842
H -1.932071 -0.937001 1.194983
H 4.493660 0.953159 -1.091203
H 4.362050 1.510030 0.595761
H -3.287520 0.674029 -1.080127
H -3.323870 1.112923 0.631885
H 5.744539 -0.470500 1.342685
H -4.511171 -1.090246 1.161135
H -4.498597 -1.506164 -0.552356
H 6.151896 -0.914174 -1.691935
H 7.132598 -1.661750 -0.396102
H 5.397470 -2.079809 -0.550415
H 6.730178 1.651956 0.705005
H -7.754217 -0.270943 -0.032746


