%chk=000183731.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183731

0 1
O -1.115688 1.681532 0.784421
O -5.721412 -1.093623 -0.419496
C 4.913678 -0.447416 0.270285
C 4.219363 0.507067 -0.730766
C 6.440819 -0.406906 0.051079
C 4.339624 -1.876940 0.183618
C 2.791480 0.780006 -0.349095
C 7.212200 -1.106181 1.167655
C 4.590321 -2.585020 -1.145269
C 1.741409 0.098436 -0.980238
C 2.499985 1.727600 0.650552
C 0.410803 0.348988 -0.632034
C 1.184524 1.992698 1.019109
C 0.154389 1.293881 0.365179
C -2.208856 0.873962 0.435853
C -2.299667 -0.453108 0.859068
C -3.249852 1.525173 -0.249950
C -4.515963 -0.525141 -0.086194
C -3.471692 -1.168545 0.591608
C -4.416913 0.821392 -0.509138
C -5.966831 -2.480997 -0.019469
C -7.367988 -2.742050 -0.535482
H 4.703727 -0.070174 1.303766
H 4.278227 0.080895 -1.752452
H 4.778734 1.463313 -0.785674
H 6.775941 0.646867 -0.018027
H 6.693780 -0.866541 -0.923974
H 3.248143 -1.832236 0.376569
H 4.765218 -2.483015 1.007898
H 6.992053 -0.668511 2.147811
H 6.964126 -2.172900 1.221451
H 8.293492 -1.029008 1.008475
H 4.122171 -3.575299 -1.157888
H 5.661930 -2.724689 -1.330208
H 4.183172 -2.016071 -1.988865
H 1.959117 -0.637755 -1.753816
H 3.312941 2.259248 1.144545
H -0.399955 -0.172357 -1.134044
H 0.939648 2.721217 1.788321
H -1.471751 -0.918663 1.392097
H -3.128700 2.564060 -0.555439
H -3.553118 -2.200539 0.915994
H -5.256512 1.278164 -1.030242
H -5.207194 -3.121192 -0.499443
H -5.896167 -2.544920 1.079796
H -7.425417 -2.596862 -1.623682
H -8.092789 -2.045492 -0.090395
H -7.694048 -3.763451 -0.309967


%chk=000183731-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183731

0 1
O -1.159608 1.811455 0.632625
O -5.903341 -1.073975 -0.344839
C 5.029198 -0.395291 0.310800
C 4.306045 0.512343 -0.736989
C 6.547848 -0.456841 -0.009679
C 4.364837 -1.795693 0.444352
C 2.855918 0.825257 -0.398197
C 7.388619 -1.240344 1.021620
C 4.490545 -2.711416 -0.795225
C 1.782075 0.279941 -1.145799
C 2.534641 1.678974 0.691713
C 0.434058 0.559591 -0.826487
C 1.198146 1.967985 1.031260
C 0.149058 1.402450 0.271646
C -2.287062 0.999376 0.335091
C -2.303083 -0.396345 0.540732
C -3.458086 1.676272 -0.076749
C -4.667886 -0.452029 -0.097908
C -3.492650 -1.127284 0.319086
C -4.645116 0.953032 -0.289430
C -5.989491 -2.532850 -0.142858
C -7.423758 -2.940551 -0.469213
H 4.921525 0.102144 1.300328
H 4.364400 0.032761 -1.733343
H 4.880713 1.458103 -0.812919
H 6.931297 0.582692 -0.070624
H 6.696257 -0.894526 -1.017948
H 3.292450 -1.650740 0.679859
H 4.803339 -2.315061 1.319017
H 7.241552 -0.837724 2.042047
H 7.118552 -2.311797 1.041800
H 8.466809 -1.173490 0.785671
H 3.982625 -3.676888 -0.615992
H 5.546772 -2.930761 -1.037023
H 4.027771 -2.256746 -1.690369
H 1.999984 -0.370120 -2.002245
H 3.343535 2.128794 1.280702
H -0.377186 0.141013 -1.429923
H 0.948010 2.629415 1.866330
H -1.399499 -0.912866 0.879776
H -3.423236 2.760458 -0.217784
H -3.487493 -2.208551 0.483672
H -5.564413 1.454338 -0.606322
H -5.264492 -3.042517 -0.811297
H -5.731507 -2.776274 0.908840
H -7.673351 -2.683836 -1.512819
H -8.136059 -2.422367 0.195107
H -7.548760 -4.030613 -0.336192


