%chk=000222848.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222848

0 1
O 5.389584 0.380882 0.147645
O -4.471884 1.697385 -0.710299
O -5.447422 -0.823404 -0.795590
O 4.960167 2.426367 -0.723138
O -5.839383 2.277075 0.999439
C 2.181802 -1.314388 -0.383729
C 2.908113 -0.001836 0.056301
C 0.812552 -1.429192 0.298648
C -0.054778 -0.225317 -0.170817
C -1.473534 -0.255379 0.486955
C 2.088246 1.176019 -0.489966
C 0.656340 1.126267 0.068360
C 4.295656 -0.219178 -0.619922
C 3.236127 -2.413842 -0.163867
C 0.115533 -2.747559 -0.071089
C 4.572909 -1.736313 -0.545056
C -2.118855 -1.627879 0.276477
C -1.269897 -2.832779 0.574045
C 3.095660 0.123473 1.573324
C -2.331253 0.848084 -0.186831
C -1.413161 -0.014125 2.005547
C -3.817126 0.697964 0.118436
C -3.403754 -1.786276 -0.084051
C -4.344175 -0.678010 -0.324640
C 5.625052 1.727761 0.006403
C 6.780457 2.110334 0.865488
C -5.548538 2.380494 -0.167582
C -6.170601 3.204751 -1.236600
H 1.998339 -1.255673 -1.488963
H 0.939870 -1.383082 1.406794
H -0.204627 -0.335618 -1.275272
H 2.070239 1.159386 -1.595823
H 2.572858 2.138710 -0.228811
H 0.682718 1.350688 1.152809
H 0.067762 1.942254 -0.393790
H 4.343384 0.194301 -1.645189
H 3.040666 -3.302368 -0.783254
H 3.249329 -2.756604 0.884166
H 0.731454 -3.607746 0.253663
H 0.024346 -2.841166 -1.171072
H 5.357808 -1.940244 0.207256
H 4.959669 -2.113992 -1.504593
H -1.172716 -2.929388 1.678136
H -1.772708 -3.766682 0.245898
H 3.533102 1.093474 1.833746
H 2.145094 0.031433 2.109606
H 3.773477 -0.647159 1.958824
H -2.188625 0.830102 -1.288257
H -1.990069 1.852592 0.132798
H -1.084922 1.006282 2.236709
H -2.392522 -0.152471 2.478319
H -0.710347 -0.698422 2.495069
H -4.066009 0.877474 1.192234
H -3.845439 -2.774574 -0.231972
H 7.604782 2.508541 0.252780
H 7.173148 1.260839 1.446159
H 6.494002 2.902460 1.574614
H -7.098080 2.723529 -1.593918
H -5.513916 3.322804 -2.113533
H -6.439803 4.203742 -0.862622


%chk=000222848-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222848

0 1
O 5.449494 0.523310 0.134855
O -4.473988 1.876769 -0.723389
O -5.405066 -0.678000 -1.286051
O 5.177893 2.205654 -1.469730
O -6.155339 1.955369 0.899446
C 2.219569 -1.322614 -0.199901
C 2.961749 -0.041680 0.302407
C 0.803882 -1.474590 0.389436
C -0.037202 -0.215151 -0.001655
C -1.532344 -0.270766 0.525321
C 2.143747 1.191724 -0.145331
C 0.681776 1.113507 0.373263
C 4.314297 -0.257360 -0.437751
C 3.254726 -2.464094 -0.007204
C 0.111890 -2.757143 -0.122686
C 4.632953 -1.772223 -0.288497
C -2.153624 -1.618509 0.115124
C -1.340178 -2.866069 0.401003
C 3.195332 -0.029083 1.835665
C -2.324778 0.906843 -0.124949
C -1.601943 -0.158084 2.083284
C -3.844471 0.739345 -0.021044
C -3.397972 -1.719528 -0.455850
C -4.306407 -0.579206 -0.667374
C 5.784843 1.736721 -0.480290
C 6.972628 2.362825 0.219781
C -5.696064 2.337842 -0.198125
C -6.324999 3.330269 -1.146410
H 2.087525 -1.190780 -1.300058
H 0.882990 -1.541327 1.495285
H -0.111265 -0.240423 -1.114131
H 2.142200 1.243519 -1.252938
H 2.611245 2.129679 0.210743
H 0.677173 1.244602 1.472192
H 0.121257 1.970379 -0.043960
H 4.205938 0.045325 -1.496729
H 3.073172 -3.312530 -0.689486
H 3.214265 -2.861697 1.024501
H 0.681665 -3.652412 0.190912
H 0.104774 -2.749212 -1.232320
H 5.341135 -1.914993 0.546312
H 5.118014 -2.165375 -1.198387
H -1.301322 -3.021247 1.500561
H -1.844880 -3.752375 -0.024418
H 3.808911 0.845700 2.113682
H 2.246713 0.032025 2.394997
H 3.732364 -0.928855 2.183261
H -2.057942 0.979709 -1.197617
H -2.045103 1.863040 0.350681
H -1.274455 0.841376 2.417874
H -2.634400 -0.311034 2.444881
H -0.963003 -0.908962 2.579539
H -4.193818 0.746928 1.031704
H -3.790960 -2.697273 -0.762868
H 7.844218 1.687752 0.163430
H 6.747306 2.516872 1.289224
H 7.217556 3.324549 -0.252987
H -6.802910 2.775079 -1.973709
H -5.561471 3.991973 -1.586241
H -7.091198 3.918713 -0.620874


