%chk=000245828.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245828

0 1
O -1.080356 -2.362657 -0.438069
O 1.075185 -2.365059 0.433151
C -0.003131 -3.204325 -0.003414
C -2.280681 -0.346794 -0.319265
C 2.277319 -0.349962 0.318983
C -2.995428 0.687537 0.556152
C 2.993100 0.685664 -0.554057
C -1.616055 -1.426603 0.534369
C 1.612036 -1.427418 -0.537118
C -3.660234 1.775111 -0.298204
C 3.658654 1.770828 0.302778
C 0.328317 -4.020197 -1.246487
C -0.335656 -4.022585 1.237791
C -4.378529 2.814392 0.574007
C 4.377976 2.811402 -0.567045
C -5.041308 3.899450 -0.271763
C 5.041501 3.894071 0.281198
H -2.990924 -0.823793 -1.024525
H -1.519228 0.139672 -0.959784
H 2.987013 -0.829029 1.023392
H 1.516102 0.135747 0.960354
H -2.275415 1.150075 1.259062
H -3.756989 0.188000 1.186249
H 2.273607 1.150326 -1.256099
H 3.754362 0.186856 -1.185092
H -2.337001 -1.979302 1.158874
H -0.793557 -1.033376 1.157153
H 2.332728 -1.979472 -1.162491
H 0.790126 -1.032150 -1.159386
H -2.901586 2.275631 -0.930237
H -4.379738 1.314689 -1.002569
H 2.900307 2.270608 0.935757
H 4.377645 1.308281 1.006273
H 0.235493 -3.412251 -2.156630
H -0.360665 -4.864816 -1.362965
H 1.350134 -4.411587 -1.194773
H -0.242400 -3.416740 2.149286
H 0.352461 -4.868143 1.352527
H -1.357867 -4.412800 1.185009
H -5.140278 2.315099 1.204328
H -3.659394 3.276968 1.278040
H 5.139425 2.312843 -1.198309
H 3.659357 3.276103 -1.270205
H -5.551397 4.636478 0.358430
H -4.308483 4.440180 -0.881416
H -5.788197 3.478951 -0.954793
H 5.552320 4.632039 -0.347302
H 4.309014 4.434087 0.891887
H 5.787914 3.471469 0.963450


%chk=000245828-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245828

0 1
O -1.084367 -2.270045 -0.546402
O 1.078376 -2.271169 0.541975
C -0.003030 -3.114070 -0.003031
C -2.497758 -0.307427 -0.375500
C 2.493404 -0.309448 0.375186
C -3.293520 0.659572 0.531054
C 3.289467 0.659191 -0.529372
C -1.755639 -1.382916 0.425611
C 1.749694 -1.382116 -0.428230
C -4.027334 1.763355 -0.263873
C 4.026036 1.759276 0.268137
C 0.447298 -3.960452 -1.202604
C -0.453403 -3.962751 1.194898
C -4.832459 2.729336 0.634830
C 4.831682 2.726773 -0.628489
C -5.555317 3.835068 -0.164722
C 5.557771 3.828405 0.173806
H -3.183049 -0.803085 -1.090573
H -1.762409 0.258507 -0.980813
H 3.178772 -0.807703 1.088376
H 1.759094 0.255578 0.982595
H -2.606921 1.133719 1.263566
H -4.033940 0.084583 1.126026
H 2.602713 1.136729 -1.259521
H 4.028255 0.084923 -1.127066
H -2.470119 -1.971733 1.039124
H -1.000851 -0.928993 1.099657
H 2.463237 -1.969910 -1.043810
H 0.994827 -0.925769 -1.100546
H -3.287567 2.343687 -0.854134
H -4.711058 1.292560 -1.000657
H 3.287959 2.338956 0.861146
H 4.709873 1.284992 1.002569
H 0.656435 -3.319410 -2.074914
H -0.354516 -4.663313 -1.484778
H 1.353885 -4.534122 -0.944377
H -0.662693 -3.323375 2.068395
H 0.348449 -4.666067 1.475823
H -1.359913 -4.536012 0.935496
H -5.574833 2.148752 1.220098
H -4.148472 3.193124 1.374897
H 5.572142 2.146751 -1.216733
H 4.147539 3.194330 -1.366021
H -6.126860 4.508855 0.499945
H -4.831887 4.452216 -0.730397
H -6.263823 3.398182 -0.893600
H 6.130054 4.503097 -0.489300
H 4.836288 4.445278 0.742260
H 6.266087 3.387586 0.900494


