%chk=000291733.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291733

0 1
O 3.180941 -0.897200 -0.163509
O 4.125924 0.786778 1.091256
O -0.931206 -3.390089 0.051988
O -3.009768 2.606506 0.313545
O -3.067563 -2.175810 0.182624
C 3.463488 0.581913 -0.123882
C 1.138125 0.249200 0.011723
C 2.069963 1.230536 -0.011266
C 1.824550 -1.067903 -0.062961
C -0.327012 0.244592 0.097767
C -0.986550 -1.051759 0.101952
C 4.295773 0.885493 -1.341465
C 1.196762 -2.262710 -0.051168
C 1.960475 2.690982 0.072043
C -0.253408 -2.223002 0.036408
C -1.038483 1.403509 0.168018
C -2.473945 -1.110567 0.181761
C -2.486189 1.337491 0.249562
C -3.176942 0.172890 0.256622
C -4.452288 2.732681 0.405675
H 4.819461 1.846606 -1.236631
H 5.055482 0.108573 -1.519278
H 3.685507 0.933079 -2.255618
H 1.725559 -3.207206 -0.101493
H 2.540481 3.080349 0.929976
H 0.912516 3.027278 0.209756
H 2.345411 3.189825 -0.831425
H -0.578021 2.391548 0.171144
H 4.909356 0.192266 1.183890
H -4.256461 0.101215 0.316456
H -0.334060 -4.187345 0.004335
H -4.584356 3.820433 0.444136
H -4.813391 2.255065 1.321774
H -4.924331 2.305083 -0.484216


%chk=000291733-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291733

0 1
O 3.207799 -0.954142 -0.161100
O 4.218592 0.825040 1.130089
O -0.933581 -3.501757 0.026256
O -3.015612 2.688800 0.264230
O -3.239390 -2.164222 0.211217
C 3.496141 0.542950 -0.085005
C 1.147804 0.187200 0.019890
C 2.114168 1.180624 0.030696
C 1.829754 -1.101904 -0.072001
C -0.320600 0.197217 0.095244
C -1.034356 -1.083957 0.104196
C 4.306274 0.883899 -1.342580
C 1.165184 -2.302735 -0.071664
C 1.982401 2.664385 0.182714
C -0.280038 -2.279398 0.021515
C -1.033721 1.397697 0.146392
C -2.528382 -1.094126 0.188125
C -2.468504 1.398592 0.220951
C -3.189763 0.214454 0.244227
C -4.476713 2.790111 0.342705
H 4.578191 1.953560 -1.340594
H 5.231606 0.279615 -1.372982
H 3.724752 0.663479 -2.252277
H 1.709445 -3.251733 -0.128798
H 2.969098 3.138381 0.309331
H 1.373476 2.917469 1.072126
H 1.480127 3.127822 -0.690726
H -0.538289 2.368392 0.121659
H 5.144719 0.475621 1.057004
H -4.281289 0.182234 0.302799
H -0.279430 -4.246373 -0.040665
H -4.690921 3.868487 0.365625
H -4.858744 2.307768 1.262576
H -4.954398 2.326850 -0.541676


