%chk=000237449.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237449

0 1
O -2.427832 2.219983 0.417935
O -4.070776 0.664466 0.906006
O -2.447323 -1.757059 -1.240108
O 0.761328 -2.088552 -1.355042
O 3.408352 -0.843702 1.864706
C 3.094845 1.110889 -0.161307
C 1.632457 1.408667 0.028972
C 3.348139 -0.366388 -0.488714
C -3.279129 1.699411 1.478517
C -1.084777 1.911115 0.378652
C 0.920498 2.141952 -0.935462
C 0.969673 0.950825 1.177998
C -3.409418 -0.563282 0.539116
C -0.439167 2.397406 -0.773390
C -0.392491 1.193554 1.362958
C -3.133421 -0.511444 -0.968207
C 3.639982 -1.208431 0.731548
C -4.257176 2.814768 1.781879
C -1.470618 -1.703483 -2.296410
C -0.158244 -1.080790 -1.812940
C 4.218760 -2.567291 0.450712
C 0.380410 -2.714125 -0.094449
C 1.041222 -4.080330 -0.128722
H 3.521975 1.744245 -0.963681
H 3.650098 1.390120 0.763309
H 2.454787 -0.814224 -1.002033
H 4.166928 -0.455965 -1.226894
H -2.677101 1.325653 2.327698
H 1.432276 2.516348 -1.821753
H 1.534798 0.393294 1.935638
H -2.490041 -0.732327 1.121257
H -4.159354 -1.336023 0.794207
H -1.005157 2.968942 -1.504757
H -0.891324 0.843357 2.262403
H -2.529781 0.370598 -1.240835
H -4.064021 -0.515102 -1.561395
H -5.218240 2.411784 2.132951
H -3.864043 3.505416 2.535728
H -4.470829 3.401372 0.872797
H -1.884283 -1.181594 -3.173839
H -1.339157 -2.780165 -2.531424
H -0.327194 -0.337054 -1.011761
H 0.410675 -0.615842 -2.639461
H 4.535086 -3.064500 1.378782
H 3.460403 -3.220323 -0.027082
H 5.084638 -2.531364 -0.218343
H 0.769892 -2.067508 0.712117
H -0.721491 -2.781884 -0.020883
H 0.840046 -4.644879 0.788101
H 2.135504 -3.989696 -0.243230
H 0.681615 -4.671736 -0.980868


%chk=000237449-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000237449

0 1
O -2.381899 2.288343 0.397780
O -4.205680 0.717842 0.578246
O -2.499533 -1.933338 -1.398115
O 0.550357 -2.878258 -1.196543
O 3.400650 -1.372137 1.315949
C 3.335240 1.371490 0.462963
C 1.824610 1.569127 0.477759
C 3.807414 0.236910 -0.481739
C -3.404023 1.682948 1.290489
C -1.008046 1.973063 0.496774
C 1.193112 2.399604 -0.487333
C 1.001013 0.942693 1.444864
C -3.556981 -0.567501 0.257052
C -0.200226 2.600669 -0.484789
C -0.401737 1.133947 1.465305
C -2.886033 -0.539858 -1.123690
C 3.662257 -1.176821 0.096127
C -4.335051 2.808684 1.717508
C -1.481630 -2.066853 -2.453253
C -0.046913 -1.785574 -1.970496
C 3.839434 -2.331288 -0.875225
C -0.029093 -3.048581 0.158742
C 0.853403 -4.035408 0.921939
H 3.823198 2.313423 0.148425
H 3.693398 1.135471 1.481288
H 3.279984 0.277845 -1.455887
H 4.885474 0.363590 -0.722847
H -2.898191 1.199298 2.151627
H 1.803333 2.909485 -1.243692
H 1.465701 0.287799 2.190426
H -2.822466 -0.848352 1.039206
H -4.368617 -1.313928 0.248398
H -0.684984 3.253541 -1.217453
H -0.985267 0.634871 2.244972
H -2.006471 0.130877 -1.123909
H -3.606753 -0.182133 -1.887807
H -5.137408 2.413719 2.362500
H -3.770792 3.581417 2.264937
H -4.789246 3.265557 0.823039
H -1.726184 -1.397301 -3.307985
H -1.551945 -3.115067 -2.792947
H -0.008008 -0.836351 -1.390758
H 0.609769 -1.681823 -2.855117
H 4.314255 -3.189843 -0.371263
H 2.826901 -2.656206 -1.199568
H 4.421662 -2.044347 -1.767913
H -0.053334 -2.058723 0.664680
H -1.069501 -3.413918 0.066835
H 0.401603 -4.259754 1.906102
H 1.859491 -3.616880 1.093681
H 0.945753 -4.982872 0.361709


