%chk=000187121.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187121

0 1
O -4.523722 -1.877957 -0.658711
O -1.764934 -2.744026 -0.633718
O -3.732888 0.507585 1.701028
O -3.513672 2.507296 -0.128068
C -3.439395 -1.287924 0.070486
C -2.160610 -1.376319 -0.806597
C -3.905418 0.158705 0.326411
C -1.138366 -0.322895 -0.430192
C -3.139527 1.195893 -0.539080
C -1.644754 0.979036 -0.407151
C 0.245364 -0.540074 -0.181811
C 1.111456 0.582377 -0.068442
C -0.789940 2.088150 -0.255611
C 0.568509 1.891395 -0.116063
C 2.547275 0.381331 0.101476
C 0.812554 -1.860165 0.001704
C 3.058256 -0.931597 0.216047
C 2.141967 -2.049771 0.187499
C 3.459030 1.470593 0.150629
C 4.454602 -1.138681 0.372006
C 4.814657 1.253907 0.302378
C 5.319073 -0.062730 0.413675
H -3.291658 -1.842263 1.026777
H -2.431626 -1.240391 -1.886162
H -5.012720 0.244992 0.183012
H -3.459996 1.162024 -1.608572
H -1.223037 3.092649 -0.265121
H 1.237295 2.751096 -0.031050
H 0.127582 -2.713570 0.037287
H -4.353661 -2.841705 -0.779329
H -1.103957 -2.996483 -1.318734
H -2.792617 0.398412 1.977091
H -3.582572 2.546033 0.862802
H 2.553434 -3.049083 0.332834
H 3.076070 2.489117 0.063855
H 4.833373 -2.156278 0.457912
H 5.507405 2.093733 0.337164
H 6.390769 -0.215411 0.532239


%chk=000187121-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187121

0 1
O -4.535818 -2.058724 -0.362774
O -1.861187 -2.790759 -0.846370
O -3.713901 0.657050 1.745353
O -3.621525 2.533081 -0.276530
C -3.414151 -1.281889 0.165361
C -2.219775 -1.361326 -0.820546
C -3.901513 0.170954 0.359057
C -1.146552 -0.323898 -0.470988
C -3.184800 1.176862 -0.592122
C -1.669585 0.991849 -0.451586
C 0.255328 -0.545778 -0.226784
C 1.133280 0.600314 -0.082557
C -0.809537 2.104549 -0.276114
C 0.566961 1.909697 -0.123461
C 2.574459 0.396012 0.112580
C 0.824602 -1.875091 -0.084804
C 3.091300 -0.946038 0.204604
C 2.177278 -2.059921 0.123339
C 3.505570 1.476216 0.217857
C 4.491059 -1.162935 0.394517
C 4.876041 1.244798 0.400933
C 5.378188 -0.085253 0.491279
H -3.079526 -1.697101 1.140321
H -2.629478 -1.100685 -1.822457
H -4.989763 0.206628 0.203996
H -3.513726 0.996753 -1.633964
H -1.249404 3.106133 -0.280161
H 1.209599 2.787832 -0.017217
H 0.149296 -2.731888 -0.084402
H -4.184366 -2.964906 -0.567763
H -1.365414 -2.990748 -1.679157
H -2.761890 0.529868 2.000217
H -3.741592 2.555901 0.713770
H 2.580595 -3.072758 0.244003
H 3.157907 2.511052 0.149903
H 4.859911 -2.193242 0.463482
H 5.565677 2.092882 0.473800
H 6.450057 -0.258489 0.635286


