%chk=000179529.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179529

0 1
O 0.592807 -1.697990 0.080652
O 3.035164 -0.000854 1.188735
O 3.558804 -0.954440 -0.800219
C -0.124486 -0.544989 0.624382
C 0.239778 0.696761 -0.162938
C -1.586786 -0.895626 0.448686
C 0.158015 1.953829 0.452645
C -2.530648 -0.381271 1.349227
C 0.650577 0.597131 -1.498650
C -1.999454 -1.718648 -0.607625
C 1.858755 -1.967304 0.680659
C 0.489470 3.104314 -0.268433
C -3.883792 -0.690965 1.187805
C 0.985585 1.749865 -2.213771
C -3.353537 -2.029279 -0.759983
C 0.904714 3.004200 -1.600447
C -4.296663 -1.515055 0.135395
C 2.903298 -0.958553 0.209629
C 3.882680 1.142076 0.892483
H 0.143401 -0.432880 1.700814
H -0.164059 2.038882 1.488394
H -2.217084 0.261130 2.169182
H 0.718543 -0.387012 -1.967724
H -1.256309 -2.118835 -1.299805
H 1.785329 -1.992266 1.784092
H 2.098936 -2.977646 0.283996
H 0.421113 4.080600 0.207803
H -4.618050 -0.289404 1.883946
H 1.310777 1.668359 -3.250018
H -3.673102 -2.671268 -1.579208
H 1.161850 3.901508 -2.159860
H -5.351094 -1.755118 0.013557
H 4.758625 0.835062 0.310474
H 4.158923 1.512213 1.884145
H 3.275519 1.866472 0.337081


%chk=000179529-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179529

0 1
O 0.533329 -1.631222 0.580081
O 3.756141 0.023188 0.939207
O 2.839718 -0.758084 -1.060139
C -0.426497 -0.525246 0.834634
C 0.005170 0.790247 0.183202
C -1.796692 -1.014877 0.361435
C 0.431133 1.875291 0.986657
C -2.927151 -0.180275 0.552589
C -0.005123 0.936497 -1.227182
C -1.966583 -2.280235 -0.248101
C 1.856545 -1.413764 1.138130
C 0.835215 3.095098 0.394961
C -4.209659 -0.605899 0.145238
C 0.402776 2.148003 -1.820400
C -3.251587 -2.703675 -0.660894
C 0.820852 3.233289 -1.011201
C -4.376862 -1.872028 -0.464664
C 2.818352 -0.690733 0.183827
C 4.805929 0.721985 0.157002
H -0.463830 -0.362245 1.936859
H 0.443283 1.770104 2.079432
H -2.800906 0.809242 1.009218
H -0.320247 0.092880 -1.850347
H -1.091800 -2.919333 -0.391332
H 1.824602 -0.869021 2.101503
H 2.270178 -2.423188 1.320309
H 1.157350 3.930388 1.026964
H -5.075280 0.048287 0.299483
H 0.398416 2.249099 -2.911353
H -3.372052 -3.684861 -1.134362
H 1.131101 4.176927 -1.474505
H -5.371708 -2.203370 -0.783337
H 5.356984 0.003579 -0.473172
H 5.463047 1.177293 0.910916
H 4.343456 1.489659 -0.485558


