%chk=000245346.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245346

0 1
O 1.928224 0.119482 1.035835
O 2.616610 1.374261 -0.718413
O 0.361880 -1.268648 -0.599994
C 7.893865 0.531452 -0.183982
C 6.641896 -0.293485 0.143735
C 9.169866 -0.309084 -0.043954
C 5.369667 0.550230 0.000683
C 10.423407 0.514647 -0.371329
C 4.120552 -0.271634 0.335949
C 11.696929 -0.316690 -0.234094
C 2.871089 0.518866 0.092438
C 0.580897 0.605916 0.873500
C -1.677903 -0.211883 -0.006040
C -4.474551 0.006545 -0.072684
C -0.195320 -0.386130 0.009123
C -5.949765 0.124344 -0.103713
C -2.292358 1.027004 0.226523
C -2.469356 -1.337885 -0.285895
C -3.682803 1.136248 0.195066
C -3.860030 -1.232281 -0.314819
C -6.641296 0.606976 1.018475
C -6.660564 -0.246519 -1.255994
C -8.034044 0.714177 0.986052
C -8.052808 -0.131897 -1.283221
C -8.741024 0.346701 -0.163526
H 7.820319 0.935119 -1.212756
H 7.949661 1.414166 0.482126
H 6.588701 -1.175451 -0.524267
H 6.716391 -0.697542 1.172024
H 9.117106 -1.191034 -0.711029
H 9.245870 -0.714166 0.983386
H 5.424528 1.439117 0.660037
H 5.287115 0.949397 -1.032466
H 10.479408 1.396786 0.296149
H 10.350219 0.918566 -1.400201
H 4.072017 -1.192562 -0.290858
H 4.152089 -0.638880 1.385271
H 12.585861 0.279249 -0.469428
H 11.820447 -0.701617 0.784508
H 11.691557 -1.178447 -0.911227
H 0.202091 0.644362 1.911886
H 0.589796 1.619774 0.423823
H -1.693153 1.916622 0.420580
H -1.982935 -2.297313 -0.486131
H -4.158525 2.101331 0.367983
H -4.470370 -2.110801 -0.523530
H -6.092461 0.890393 1.915305
H -6.125395 -0.616309 -2.129805
H -8.569598 1.085026 1.858782
H -8.602539 -0.416394 -2.179372
H -9.825960 0.433093 -0.186811


%chk=000245346-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245346

0 1
O 1.937813 0.095929 1.738201
O 2.506043 1.240732 -0.214194
O 0.465003 -1.376591 -0.017892
C 7.838979 0.468983 -0.395016
C 6.673220 -0.229326 0.340907
C 9.192528 -0.256948 -0.225568
C 5.327846 0.509706 0.173036
C 10.358236 0.443738 -0.960461
C 4.179378 -0.190529 0.927137
C 11.708109 -0.284642 -0.782923
C 2.832960 0.467775 0.711189
C 0.544969 0.501832 1.535125
C -1.647462 -0.275363 0.378275
C -4.464964 0.008197 -0.070144
C -0.177580 -0.466847 0.575325
C -5.928163 0.157635 -0.305761
C -2.382313 0.764799 1.010623
C -2.340890 -1.170378 -0.481892
C -3.764618 0.902089 0.788236
C -3.720693 -1.031779 -0.699710
C -6.786313 0.656195 0.714070
C -6.506229 -0.194455 -1.557589
C -8.171941 0.797797 0.491157
C -7.891528 -0.051509 -1.782067
C -8.732210 0.445124 -0.758755
H 7.596239 0.545029 -1.475458
H 7.933676 1.511212 -0.024482
H 6.573556 -1.269026 -0.035670
H 6.920518 -0.311704 1.420342
H 9.100855 -1.299144 -0.597209
H 9.436110 -0.333333 0.855106
H 5.427660 1.551151 0.537804
H 5.066417 0.582677 -0.899480
H 10.447023 1.485866 -0.590918
H 10.115720 0.517259 -2.040383
H 4.078406 -1.240351 0.583085
H 4.377515 -0.246319 2.013423
H 12.523582 0.234909 -1.319188
H 11.989536 -0.342946 0.285643
H 11.653617 -1.319376 -1.171164
H 0.086634 0.482980 2.537648
H 0.503182 1.527458 1.118807
H -1.880379 1.484048 1.666823
H -1.768536 -1.971998 -0.960381
H -4.303671 1.732315 1.257055
H -4.239042 -1.752824 -1.340761
H -6.372258 0.902561 1.698326
H -5.863620 -0.550195 -2.370770
H -8.815647 1.173852 1.294016
H -8.313843 -0.318497 -2.757092
H -9.808130 0.555429 -0.932733


