%chk=000190020.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190020

0 1
O -0.472541 -0.999712 -1.441103
O -0.135068 2.047441 0.450550
C 2.292659 0.198948 0.380352
C -0.614591 -0.272636 -0.190974
C 3.836961 0.063591 0.170073
C 1.594910 0.873457 -0.816352
C 1.612428 -1.158881 0.649102
C 0.095583 1.073761 -0.571626
C 0.120566 -0.986237 0.956604
C -2.091148 -0.030468 0.089311
C 4.472045 -0.556100 1.433059
C 4.166585 -0.818258 -1.046526
C 4.450242 1.464081 -0.037065
C -2.586160 0.110434 1.391898
C -2.973683 0.093554 -0.996568
C -0.947338 -2.358491 -1.456377
C -3.947154 0.352912 1.606901
C -4.331641 0.333597 -0.780850
C -4.822496 0.461406 0.523292
H 2.143333 0.849365 1.278665
H 2.060695 1.853125 -1.035832
H 1.720471 0.250624 -1.727120
H 2.107441 -1.680250 1.489155
H 1.730098 -1.812453 -0.239420
H -0.409229 1.528702 -1.455317
H -0.343086 -1.971889 1.148778
H -0.009959 -0.409960 1.893957
H 4.100507 -1.569113 1.618964
H 5.560349 -0.624989 1.333639
H 4.264571 0.042747 2.324830
H 3.737769 -0.409568 -1.967806
H 3.776053 -1.833898 -0.927581
H 5.247725 -0.899286 -1.198060
H 4.232195 2.130126 0.803257
H 5.539213 1.408917 -0.135503
H 4.068539 1.943598 -0.944998
H 0.377995 1.832978 1.256910
H -1.914821 0.045937 2.246726
H -2.584827 -0.000267 -2.012629
H -0.265666 -2.999203 -0.890262
H -0.915890 -2.605120 -2.524632
H -1.968665 -2.428975 -1.070798
H -4.322359 0.462837 2.622512
H -5.007882 0.427499 -1.628360
H -5.880331 0.650918 0.691924


%chk=000190020-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190020

0 1
O -0.434264 -1.052884 -1.391830
O -0.145297 2.094970 0.554687
C 2.338346 0.206787 0.375689
C -0.628241 -0.259982 -0.138386
C 3.889432 0.058730 0.120551
C 1.579405 0.891754 -0.795863
C 1.623179 -1.125959 0.729856
C 0.077296 1.092774 -0.504278
C 0.124236 -0.913219 1.044839
C -2.128615 -0.038468 0.100872
C 4.570608 -0.549824 1.379056
C 4.196428 -0.847497 -1.102928
C 4.516170 1.460663 -0.125571
C -2.729001 -0.101470 1.381726
C -2.952046 0.268058 -1.015182
C -0.987768 -2.408841 -1.371504
C -4.113093 0.137772 1.546203
C -4.332625 0.506494 -0.856216
C -4.921038 0.444195 0.429187
H 2.264789 0.867645 1.276292
H 2.010420 1.884391 -1.018885
H 1.663346 0.268362 -1.703501
H 2.103082 -1.606542 1.601946
H 1.712213 -1.822806 -0.125179
H -0.429456 1.517191 -1.387270
H -0.350218 -1.874447 1.319549
H 0.025822 -0.256398 1.932628
H 4.267821 -1.598414 1.549869
H 5.670391 -0.539076 1.260669
H 4.323201 0.031496 2.288648
H 3.774769 -0.432562 -2.036222
H 3.793043 -1.867799 -0.969886
H 5.290610 -0.935796 -1.241934
H 4.273057 2.158627 0.699066
H 5.617923 1.381174 -0.186743
H 4.165021 1.912253 -1.070191
H 0.534068 1.961973 1.263698
H -2.124458 -0.330602 2.265024
H -2.499034 0.299888 -2.012894
H -0.446148 -3.067530 -0.662399
H -0.852773 -2.794437 -2.395133
H -2.065533 -2.408433 -1.116320
H -4.557760 0.088321 2.546903
H -4.949701 0.742431 -1.730867
H -5.993210 0.631837 0.556923


