%chk=000252380.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252380

0 1
O 5.197991 -0.881100 -0.538970
O -5.773326 0.218226 0.108863
C 2.747644 -0.530558 -0.221195
C 2.063850 0.724600 0.409036
C 0.666182 0.950807 -0.187234
C -0.203864 -0.292322 0.162988
C -1.651514 -0.127955 -0.400692
C 4.196460 -0.409299 0.384122
C 1.912170 -1.758763 0.177742
C 0.463494 -1.599786 -0.317371
C 3.117739 1.836435 0.263341
C 0.029244 2.241753 0.356475
C -2.250894 1.178036 0.214178
C 4.466858 1.118378 0.474029
C -1.408855 2.411367 -0.146332
C 2.861283 -0.452492 -1.751795
C -1.660966 -0.104249 -1.938659
C -2.529130 -1.284873 0.042027
C 4.402968 -1.135646 1.711008
C -3.715970 1.359312 -0.201664
C -3.847939 -1.171813 0.255837
C -4.563189 0.133662 0.069177
C -4.699527 -2.317106 0.691316
H 1.934194 0.534290 1.505603
H 0.746499 1.034045 -1.298759
H -0.286870 -0.347060 1.277181
H 1.913966 -1.891845 1.275635
H 2.350334 -2.681440 -0.242411
H 0.445734 -1.644571 -1.424508
H -0.135114 -2.465842 0.028036
H 2.967801 2.642783 0.997197
H 3.070681 2.306126 -0.733664
H 0.636668 3.114400 0.050172
H 0.044653 2.239357 1.463073
H -2.227647 1.059697 1.328863
H 5.203214 1.400797 -0.302478
H 4.923285 1.389585 1.437818
H -1.857610 3.320009 0.297539
H -1.413974 2.577247 -1.240480
H 3.177727 -1.408608 -2.178966
H 1.907708 -0.175353 -2.214990
H 3.608064 0.291534 -2.059614
H -1.214607 -1.015266 -2.354222
H -2.679293 -0.031723 -2.335387
H -1.091443 0.747595 -2.327457
H -2.020127 -2.243483 0.160026
H 4.218352 -2.210920 1.628235
H 5.440341 -1.016755 2.052062
H 3.750074 -0.741409 2.496611
H -3.794828 1.605531 -1.281717
H -4.163003 2.232750 0.316489
H 5.095227 -1.831992 -0.714833
H -4.431069 -3.253579 0.188003
H -5.767099 -2.126498 0.482000
H -4.615747 -2.482217 1.774713


%chk=000252380-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252380

0 1
O 5.311569 -1.081497 -0.326024
O -5.803250 0.237355 0.662389
C 2.807064 -0.540412 -0.277668
C 2.092803 0.717475 0.311226
C 0.681729 0.960322 -0.266114
C -0.199089 -0.306701 0.019052
C -1.690456 -0.109997 -0.466363
C 4.214096 -0.442311 0.444208
C 1.930934 -1.778712 0.033387
C 0.488574 -1.597080 -0.515197
C 3.160744 1.835586 0.195096
C 0.049168 2.246055 0.321277
C -2.247978 1.185960 0.220630
C 4.517481 1.093865 0.434181
C -1.416537 2.438930 -0.121790
C 3.039060 -0.428509 -1.810645
C -1.767588 -0.039006 -2.025878
C -2.570336 -1.278034 -0.030922
C 4.238952 -1.027709 1.873261
C -3.755397 1.369372 -0.042798
C -3.885030 -1.184495 0.349208
C -4.575049 0.141429 0.355711
C -4.717975 -2.385403 0.747130
H 1.943999 0.519819 1.397971
H 0.768802 1.097356 -1.364209
H -0.250275 -0.404598 1.129448
H 1.869884 -1.931223 1.129501
H 2.373061 -2.700428 -0.399190
H 0.514764 -1.581564 -1.620852
H -0.101323 -2.489011 -0.230598
H 2.998712 2.647927 0.925323
H 3.131792 2.295387 -0.811247
H 0.657025 3.123501 0.028325
H 0.086539 2.189453 1.430585
H -2.130679 1.014074 1.314430
H 5.248473 1.296458 -0.367131
H 4.986651 1.399854 1.386133
H -1.853355 3.320932 0.387790
H -1.466151 2.649925 -1.209199
H 3.523619 -1.345368 -2.189492
H 2.094243 -0.290842 -2.362767
H 3.709219 0.409261 -2.065411
H -1.470803 -1.002516 -2.476935
H -2.797023 0.170408 -2.364692
H -1.106199 0.743380 -2.437164
H -2.120744 -2.280759 -0.072013
H 4.053207 -2.119196 1.872787
H 5.235336 -0.851789 2.315953
H 3.484913 -0.558380 2.530554
H -3.945901 1.577435 -1.116029
H -4.155060 2.239014 0.511296
H 5.215136 -2.066096 -0.253824
H -4.135455 -3.320338 0.679456
H -5.612710 -2.470697 0.104206
H -5.096388 -2.274063 1.779637


