%chk=000253619.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253619

0 1
O -0.209598 1.517252 -2.558417
O -2.608328 1.014045 1.552221
O -1.936544 -3.079646 -1.588747
O -2.511214 -3.434585 0.471272
O 0.356918 4.428047 0.922893
O 4.588384 -1.560576 0.183613
O 3.650299 -0.974132 -1.676896
N 0.051336 2.974700 -0.843971
N -1.158221 2.716311 1.220681
N -2.302535 -2.720826 -0.487765
N 3.622768 -1.239691 -0.487960
C -1.301708 -0.424844 -0.707599
C -1.613308 1.099087 -0.644643
C -0.072086 -0.760188 0.110197
C -2.538642 -1.236445 -0.287654
C -0.547561 1.837787 -1.443918
C -1.847745 1.561155 0.782764
C 1.164532 -0.846848 -0.542685
C -0.141844 -0.988958 1.494498
C -0.198822 3.457200 0.469393
C 2.310261 -1.157284 0.201673
C 1.008086 -1.306110 2.222424
C 2.245877 -1.395100 1.582077
H -1.092966 -0.672512 -1.795109
H -2.587513 1.277379 -1.195831
H -3.429628 -0.942367 -0.887890
H -2.819722 -1.043428 0.781530
H 1.251754 -0.676933 -1.625639
H -1.104528 -0.923229 2.014154
H 0.760824 3.489697 -1.397613
H -1.342639 3.049683 2.184094
H 0.938091 -1.491413 3.296537
H 3.156623 -1.647128 2.138115


%chk=000253619-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253619

0 1
O -0.319587 1.545141 -2.634974
O -2.719125 1.110859 1.580681
O -1.716562 -3.042319 -1.657075
O -2.805007 -3.569414 0.278031
O 0.427224 4.464708 0.910237
O 4.684490 -1.568650 0.208030
O 3.651395 -1.043259 -1.756562
N 0.022961 2.981000 -0.851459
N -1.141898 2.757645 1.201075
N -2.334593 -2.731224 -0.573106
N 3.639007 -1.269583 -0.486722
C -1.315538 -0.419918 -0.667296
C -1.646529 1.123984 -0.622674
C -0.066522 -0.770766 0.148721
C -2.560195 -1.243850 -0.281212
C -0.602357 1.882076 -1.458726
C -1.887382 1.643338 0.797982
C 1.177600 -0.869675 -0.517138
C -0.112663 -0.993156 1.552019
C -0.182245 3.472055 0.451840
C 2.335705 -1.173550 0.226610
C 1.060605 -1.305033 2.274904
C 2.304367 -1.397018 1.618751
H -1.103698 -0.632438 -1.731596
H -2.608753 1.254151 -1.161529
H -3.428195 -0.951900 -0.900482
H -2.846757 -1.172689 0.775171
H 1.259165 -0.726072 -1.599391
H -1.064465 -0.932124 2.090132
H 0.717471 3.488114 -1.411453
H -1.308257 3.110531 2.150183
H 1.002332 -1.481774 3.353372
H 3.228605 -1.639087 2.149454


