%chk=000254638.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254638

0 1
O -4.750508 0.858090 -0.505645
O 4.145367 1.229553 0.997116
C -1.540446 -0.774848 0.322256
C -2.286286 0.475301 -0.240973
C -0.104913 -0.855630 -0.217416
C 0.655674 0.415328 0.263847
C 2.131782 0.402852 -0.244988
C -3.744202 0.214775 0.296066
C -1.563258 1.725699 0.284806
C -0.083639 1.710308 -0.139495
C 2.812845 -0.899190 0.277653
C -2.503649 -1.942512 0.043140
C 0.605753 -2.128924 0.276116
C -3.910146 -1.334623 0.223296
C 2.067446 -2.161607 -0.183833
C -2.322718 0.513122 -1.778337
C 2.903158 1.606749 0.369101
C 2.190811 0.496444 -1.777792
C 4.296738 -0.953592 -0.130168
C -4.034843 0.776377 1.683475
C 4.989286 0.374415 0.204053
H -1.472257 -0.663104 1.435547
H -0.123250 -0.870089 -1.332497
H 0.689144 0.381182 1.382004
H -1.631000 1.780893 1.387053
H -2.056152 2.640239 -0.094025
H -0.014833 1.851730 -1.237172
H 0.424601 2.584869 0.308076
H 2.777754 -0.857377 1.397998
H -2.334063 -2.783693 0.733032
H -2.368082 -2.343168 -0.974864
H 0.075387 -3.023573 -0.099673
H 0.556503 -2.190729 1.379998
H -4.579764 -1.609867 -0.606639
H -4.395814 -1.721068 1.133469
H 2.567329 -3.061876 0.220072
H 2.116794 -2.257072 -1.285153
H -1.312858 0.606201 -2.197380
H -2.759736 -0.395384 -2.203166
H -2.898534 1.377022 -2.131389
H 3.124738 2.385002 -0.379417
H 2.373627 2.064385 1.225322
H 3.222219 0.563522 -2.138390
H 1.737692 -0.384641 -2.247049
H 1.651555 1.375644 -2.148421
H 4.396895 -1.178977 -1.207248
H 4.791963 -1.788801 0.398430
H -3.986608 1.873365 1.677181
H -5.055970 0.519748 1.995963
H -3.338547 0.396279 2.435590
H 5.857055 0.243305 0.875588
H 5.298048 0.919786 -0.703256
H -4.733888 0.550261 -1.429064


%chk=000254638-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000254638

0 1
O -4.844722 0.989215 -0.337726
O 4.166098 1.252419 1.114620
C -1.565514 -0.772185 0.244972
C -2.334264 0.483456 -0.271083
C -0.113644 -0.868471 -0.270642
C 0.654032 0.424351 0.164349
C 2.172389 0.407074 -0.254243
C -3.770434 0.234116 0.350089
C -1.574189 1.748131 0.194692
C -0.095566 1.713626 -0.282128
C 2.826149 -0.901519 0.310135
C -2.540595 -1.947683 -0.022969
C 0.598450 -2.138266 0.255740
C -3.958373 -1.325243 0.197103
C 2.087486 -2.176239 -0.150132
C -2.473189 0.498206 -1.820488
C 2.913420 1.618153 0.431222
C 2.332330 0.508401 -1.796704
C 4.346005 -0.969052 0.008953
C -3.919797 0.691757 1.810562
C 5.012558 0.413378 0.251870
H -1.486785 -0.660731 1.350560
H -0.130745 -0.925545 -1.379895
H 0.649574 0.418597 1.280857
H -1.585572 1.801710 1.301117
H -2.072696 2.664607 -0.178073
H -0.062796 1.805439 -1.384382
H 0.427795 2.605542 0.114777
H 2.719477 -0.838880 1.413629
H -2.357539 -2.804848 0.648204
H -2.423623 -2.317781 -1.060064
H 0.078676 -3.042705 -0.115998
H 0.522246 -2.158925 1.364345
H -4.633050 -1.541379 -0.653371
H -4.449839 -1.736972 1.096261
H 2.578730 -3.064461 0.296531
H 2.175576 -2.292618 -1.249716
H -1.494750 0.468970 -2.327387
H -3.051354 -0.365404 -2.201387
H -2.980235 1.425689 -2.144214
H 3.133881 2.409813 -0.319352
H 2.297646 2.055591 1.236383
H 3.391069 0.423595 -2.101522
H 1.771206 -0.278647 -2.330085
H 1.969279 1.484560 -2.165768
H 4.519137 -1.298939 -1.034451
H 4.797026 -1.737223 0.665233
H -3.824754 1.788080 1.884973
H -4.923335 0.413219 2.176052
H -3.167034 0.221590 2.467152
H 5.970659 0.324821 0.789625
H 5.197297 0.945956 -0.708069
H -4.919596 0.655753 -1.267357


