%chk=000237521.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237521

0 1
O -4.436200 -0.817377 0.373585
O -4.317510 2.078966 0.504198
O -1.626585 3.238341 0.407462
O -3.376093 -2.909789 0.123997
O 4.135335 1.187870 1.810226
O 5.422467 1.389038 -0.813649
O 2.047470 -3.654126 0.527382
O 1.856268 -3.682937 -1.702530
C -0.831329 -0.265632 -0.021596
C 0.350502 -1.068480 -0.253509
C -2.099967 -0.910773 0.098697
C 0.233651 -2.436817 -0.357968
C 1.670550 -0.410460 -0.377264
C -3.267224 -0.106334 0.317970
C -2.141397 -2.341218 -0.007945
C -0.750605 1.138510 0.101468
C -1.010247 -3.103683 -0.234032
C -3.180774 1.286052 0.363155
C -1.894215 1.906142 0.297699
C 2.324593 0.055758 0.772758
C 2.268681 -0.271617 -1.639822
C 3.571520 0.675549 0.647435
C 1.427547 -3.291264 -0.644246
C 3.507519 0.358993 -1.768397
C 4.158818 0.842568 -0.627279
C -5.423860 -0.409665 1.363778
C -5.048500 2.220884 -0.751742
C -2.695286 4.150874 0.776018
C 5.409945 0.580815 2.161695
C 5.531102 2.780391 -0.402538
H 0.217538 1.641061 0.043598
H -1.056663 -4.184312 -0.316975
H 1.877826 -0.059940 1.760787
H 1.761287 -0.656041 -2.525934
H 3.979870 0.479633 -2.742957
H -3.341440 -3.900035 0.036309
H -5.051300 -0.693254 2.352578
H -5.639549 0.662647 1.313924
H -6.288506 -1.016674 1.072274
H -5.888000 2.859272 -0.460540
H -5.388562 1.240188 -1.099688
H -4.415459 2.702571 -1.501140
H -3.350351 4.306089 -0.084884
H -2.132263 5.056948 1.030132
H -3.258720 3.766700 1.633369
H 2.855967 -4.214918 0.371729
H 6.116073 0.650483 1.326342
H 5.242595 -0.459055 2.455178
H 5.728646 1.189259 3.014322
H 5.201116 2.906338 0.635165
H 4.943242 3.401559 -1.083643
H 6.603477 2.971201 -0.513255


%chk=000237521-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237521

0 1
O -4.690598 -0.447404 0.037266
O -4.295651 2.294669 0.148711
O -1.647960 3.371424 -0.027495
O -3.588631 -2.905299 0.031232
O 4.123781 1.287118 1.866745
O 5.413725 1.471933 -0.756879
O 2.489123 -3.052979 0.058845
O 1.054809 -4.724307 -0.634902
C -0.895544 -0.279588 -0.076975
C 0.291833 -1.108203 -0.185468
C -2.228939 -0.864880 -0.009965
C 0.128563 -2.509339 -0.231154
C 1.631772 -0.441986 -0.311487
C -3.361316 0.021864 0.067694
C -2.322721 -2.303036 -0.060440
C -0.765447 1.145364 -0.043258
C -1.179606 -3.086984 -0.181122
C -3.193729 1.422230 0.077725
C -1.873023 1.987805 0.040021
C 2.272915 0.123439 0.816800
C 2.272191 -0.359476 -1.573615
C 3.531377 0.746088 0.698388
C 1.225488 -3.518943 -0.311092
C 3.518753 0.287654 -1.704823
C 4.151947 0.856843 -0.579527
C -5.263355 -0.771474 1.359942
C -5.192869 2.287067 -1.034613
C -2.210577 4.198902 1.064779
C 5.392949 0.632673 2.262233
C 5.454966 2.913985 -0.416396
H 0.222794 1.605824 -0.101789
H -1.248667 -4.180474 -0.232368
H 1.820880 0.058678 1.811749
H 1.788294 -0.793813 -2.454892
H 4.015679 0.374370 -2.676463
H -3.494821 -3.887292 -0.064728
H -4.728563 -1.627594 1.807657
H -5.220381 0.112428 2.024584
H -6.310421 -1.049850 1.165956
H -5.991473 3.005687 -0.795206
H -5.607899 1.277564 -1.189717
H -4.635219 2.623519 -1.928250
H -3.301993 4.063578 1.137002
H -1.962579 5.235782 0.792116
H -1.724168 3.936936 2.024183
H 3.136091 -3.804212 -0.036919
H 6.138831 0.692246 1.448790
H 5.207027 -0.426331 2.523971
H 5.742961 1.182492 3.149280
H 5.150428 3.082702 0.632027
H 4.791250 3.482339 -1.095296
H 6.500727 3.220561 -0.571159


