%chk=000183509.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183509

0 1
O -1.186268 -1.352992 0.532449
O -0.659433 0.338377 -0.873153
O 4.210724 -0.654612 -0.256337
C -1.881497 0.765087 1.244430
C -3.195387 1.328978 0.676826
C -0.947994 1.871505 1.811707
C -4.249203 0.231444 0.479806
C -5.531442 0.796914 -0.144705
C 0.340084 1.247162 2.360055
C -0.626385 2.953565 0.778735
C -1.169354 -0.019731 0.161558
C -6.592397 -0.296307 -0.328678
C -7.876120 0.266386 -0.955072
C -8.935917 -0.817348 -1.140073
C -0.479744 -2.313105 -0.305338
C 0.953133 -2.384035 0.153898
C 1.864427 -1.419012 -0.298699
C 1.364949 -3.396403 1.028893
C 3.181787 -1.493487 0.156881
C 2.697988 -3.452798 1.458814
C 3.622201 -2.501781 1.033980
C 3.939874 0.626913 -0.745251
C 2.951752 1.466654 -0.224314
C 4.839219 1.040130 -1.740615
C 2.865176 2.767408 -0.729746
C 4.733272 2.345484 -2.220469
C 3.748570 3.207701 -1.720461
H -2.124830 0.061983 2.087340
H -3.000175 1.847018 -0.284969
H -3.586503 2.106329 1.362375
H -1.498559 2.347302 2.663642
H -4.482088 -0.249596 1.449767
H -3.842046 -0.575615 -0.161545
H -5.934926 1.609332 0.489899
H -5.300046 1.263612 -1.122145
H 0.895234 1.964040 2.975308
H 1.019692 0.926397 1.550949
H 0.141896 0.367838 2.982938
H -0.235487 2.515514 -0.153696
H 0.125272 3.653855 1.157219
H -1.511971 3.538298 0.510240
H -6.191086 -1.109260 -0.964134
H -6.825790 -0.765633 0.646284
H -7.644594 0.732812 -1.932780
H -8.280077 1.079285 -0.320464
H -8.581758 -1.620516 -1.796346
H -9.216699 -1.275241 -0.184835
H -9.847987 -0.406868 -1.587638
H -1.050987 -3.241489 -0.121379
H -0.570938 -2.013627 -1.367865
H 1.539272 -0.638451 -0.992261
H 0.653018 -4.137967 1.384047
H 3.013195 -4.246039 2.137259
H 4.660768 -2.522801 1.356195
H 2.262315 1.124675 0.554453
H 5.593038 0.350094 -2.112294
H 2.100170 3.441831 -0.344400
H 5.419237 2.693434 -2.992566
H 3.670623 4.221660 -2.106120


%chk=000183509-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183509

0 1
O -0.997918 -1.620989 1.089402
O -0.895836 0.011406 -0.574055
O 4.317032 -0.572590 -0.768401
C -2.031644 0.507900 1.574660
C -3.237956 1.192041 0.879787
C -1.074020 1.541249 2.278085
C -4.356326 0.207934 0.469546
C -5.555368 0.917347 -0.198965
C 0.071184 0.831405 3.039094
C -0.516652 2.618851 1.318214
C -1.263256 -0.346043 0.572034
C -6.685815 -0.050004 -0.615859
C -7.881386 0.664040 -1.287297
C -9.009176 -0.305821 -1.701195
C -0.201380 -2.551490 0.205649
C 1.284116 -2.428716 0.467721
C 2.060601 -1.503044 -0.274558
C 1.905838 -3.248246 1.443265
C 3.446762 -1.400051 -0.019561
C 3.295104 -3.141050 1.677864
C 4.072676 -2.216463 0.949685
C 3.900139 0.682214 -1.285784
C 2.993199 1.532776 -0.612633
C 4.533208 1.089477 -2.480648
C 2.713326 2.804055 -1.161520
C 4.247752 2.365240 -3.013135
C 3.334994 3.226520 -2.359275
H -2.403441 -0.174917 2.362847
H -2.880759 1.730912 -0.017931
H -3.653787 1.951061 1.573796
H -1.713928 2.052667 3.028669
H -4.708568 -0.349856 1.362446
H -3.946931 -0.548048 -0.231774
H -5.964400 1.680845 0.496089
H -5.198127 1.470369 -1.092580
H 0.647221 1.561865 3.636686
H 0.774471 0.335530 2.343694
H -0.315889 0.054984 3.724040
H 0.051513 2.158580 0.490180
H 0.157085 3.301066 1.870048
H -1.320885 3.229508 0.871560
H -6.278398 -0.813321 -1.311396
H -7.045528 -0.603944 0.276647
H -7.520297 1.216233 -2.178966
H -8.285278 1.428240 -0.591877
H -8.638595 -1.060079 -2.420899
H -9.407056 -0.848810 -0.823049
H -9.851209 0.229902 -2.177034
H -0.584472 -3.544025 0.489115
H -0.454081 -2.318831 -0.842970
H 1.579354 -0.879571 -1.035094
H 1.303656 -3.963854 2.014591
H 3.775819 -3.777896 2.428101
H 5.150408 -2.117516 1.109445
H 2.519795 1.215893 0.321806
H 5.236034 0.406849 -2.967588
H 2.008082 3.465031 -0.645602
H 4.736682 2.683826 -3.940312
H 3.111513 4.213662 -2.777206


