%chk=000194501.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194501

0 1
O -0.007928 0.127141 1.142730
O 3.816407 1.112552 -1.248674
O 3.728302 -1.042429 -0.679522
O -1.404624 -3.237550 1.314274
O -2.029021 -2.262058 -0.599815
C -1.004117 2.338795 1.253031
C -2.124855 2.396760 0.199280
C 0.129934 1.506491 0.806956
C -2.876149 1.064448 0.090212
C 1.300105 1.703326 0.114307
C 1.100772 -0.512438 0.626560
C 1.935017 0.400237 -0.002360
C -3.910134 1.085291 -1.043708
C 1.174668 -1.976139 0.831995
C 1.833720 2.977261 -0.401982
C 0.346229 -2.745572 -0.202132
C -4.615111 -0.263079 -1.171881
C 3.189910 0.048769 -0.634288
C -1.127653 -2.683527 0.083652
H -0.642975 3.365774 1.477666
H -1.408227 1.944469 2.212227
H -1.696765 2.671278 -0.785053
H -2.830259 3.208075 0.462508
H -2.155464 0.235513 -0.081631
H -3.373577 0.828042 1.049285
H -3.411824 1.334681 -2.001264
H -4.653640 1.885827 -0.868370
H 2.247806 -2.294772 0.749070
H 0.847356 -2.247173 1.863624
H 2.399312 2.822602 -1.339116
H 1.044286 3.711737 -0.607285
H 2.540796 3.429258 0.311526
H 0.671234 -3.811347 -0.218070
H 0.536781 -2.355149 -1.228966
H -5.215735 -0.493258 -0.286396
H -5.279882 -0.285490 -2.040909
H -3.887286 -1.081502 -1.291888
H 4.675060 0.834325 -1.672049
H -2.372568 -3.202871 1.540859


%chk=000194501-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000194501

0 1
O 0.017690 0.189404 1.295515
O 3.863658 0.963754 -1.196498
O 3.588299 -1.269243 -0.631796
O -1.633319 -3.095721 0.653061
O -1.250890 -2.022977 -1.369119
C -0.987839 2.460791 1.225960
C -2.185176 2.453123 0.226966
C 0.133628 1.542758 0.846727
C -2.877931 1.078828 0.095559
C 1.292316 1.678892 0.099207
C 1.115274 -0.517795 0.807678
C 1.921737 0.356092 0.069448
C -4.096597 1.100953 -0.854756
C 1.180239 -1.978432 1.122362
C 1.778931 2.946383 -0.552493
C 0.662005 -2.881414 -0.047446
C -4.733305 -0.296105 -1.025439
C 3.152939 -0.085258 -0.584675
C -0.794151 -2.614220 -0.365103
H -0.589681 3.489936 1.306053
H -1.354962 2.179377 2.231855
H -1.826844 2.780839 -0.769684
H -2.922198 3.209740 0.566512
H -2.151844 0.331051 -0.275631
H -3.199690 0.733325 1.100765
H -3.776588 1.480131 -1.846581
H -4.853713 1.817132 -0.473964
H 2.231570 -2.259084 1.303168
H 0.588310 -2.181438 2.031527
H 1.828236 2.837588 -1.650605
H 1.109501 3.791933 -0.318313
H 2.799924 3.199311 -0.218913
H 0.777371 -3.936574 0.256722
H 1.264591 -2.697537 -0.950091
H -5.091497 -0.688217 -0.053257
H -5.597701 -0.268724 -1.714163
H -3.992345 -1.008664 -1.435085
H 4.676361 0.575101 -1.620731
H -2.576409 -2.856740 0.439660


