%chk=000181171.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181171

0 1
O 0.477766 0.593984 -0.310975
O 0.350565 -1.009301 -1.900192
C -1.773452 1.555695 -0.360842
C -1.604604 2.149947 1.052590
C -2.480636 0.190255 -0.275911
C 1.658397 -1.428347 0.129944
C -0.415751 1.463039 -1.075208
C 1.056429 -1.464040 1.545030
C 3.066992 -0.807107 0.135592
C -1.344998 3.662098 1.025658
C -2.818063 -0.399092 -1.650975
C 0.763862 -0.648390 -0.820389
C -0.298122 -2.183293 1.579436
C 3.785421 -0.993586 -1.207628
C -1.188738 4.230793 2.434464
C -3.694852 -1.643529 -1.528808
C -0.829423 -2.313548 3.003525
C 5.171795 -0.355495 -1.193284
H -2.414334 2.244618 -0.969016
H -2.506940 1.942762 1.658694
H -0.770461 1.630392 1.567137
H -1.839779 -0.528205 0.290867
H -3.407637 0.296641 0.319919
H 1.718745 -2.475393 -0.270071
H -0.509100 1.084135 -2.109614
H 0.129358 2.423459 -1.066078
H 1.766092 -1.965752 2.231329
H 0.941324 -0.428223 1.926487
H 3.667262 -1.265571 0.945688
H 2.998737 0.271368 0.385697
H -2.174859 4.178970 0.505163
H -0.432586 3.878463 0.435409
H -1.877829 -0.661621 -2.186754
H -3.327604 0.356833 -2.277728
H -0.213724 -3.184918 1.115433
H -1.036936 -1.619092 0.955496
H 3.871069 -2.072455 -1.445404
H 3.180260 -0.556276 -2.027924
H -1.000459 5.309833 2.407447
H -0.351054 3.764790 2.966090
H -2.089333 4.069785 3.037713
H -3.910055 -2.069518 -2.515621
H -4.653986 -1.420947 -1.049328
H -3.202510 -2.425337 -0.939237
H -0.154044 -2.900085 3.636863
H -1.805231 -2.812926 3.016694
H -0.957064 -1.333990 3.478886
H 5.119025 0.722908 -1.003703
H 5.678257 -0.492768 -2.155917
H 5.813310 -0.794163 -0.420742


%chk=000181171-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181171

0 1
O 0.435961 0.476761 -0.304251
O 0.266031 -1.333489 -1.771167
C -1.814518 1.560867 -0.494760
C -1.670556 2.196727 0.915361
C -2.696103 0.283985 -0.439417
C 1.717483 -1.498111 0.232699
C -0.450450 1.315913 -1.170839
C 1.140289 -1.597860 1.672330
C 3.084858 -0.753692 0.224013
C -0.931888 3.554366 0.954691
C -3.102900 -0.297278 -1.813474
C 0.735291 -0.825009 -0.725646
C -0.125849 -2.476249 1.785909
C 3.757581 -0.677785 -1.165022
C -0.960795 4.197521 2.358485
C -4.086847 -1.479949 -1.679150
C -0.646876 -2.575446 3.235532
C 5.142413 0.002240 -1.109095
H -2.330531 2.299646 -1.150490
H -2.688368 2.333511 1.336121
H -1.148644 1.479263 1.580178
H -2.171491 -0.497438 0.147851
H -3.616295 0.528834 0.130640
H 1.863683 -2.519856 -0.169697
H -0.561000 0.814053 -2.147208
H 0.108109 2.258219 -1.297464
H 1.930544 -2.018336 2.327641
H 0.923716 -0.577471 2.044188
H 3.761318 -1.281918 0.926792
H 2.937639 0.268569 0.623931
H -1.394190 4.247360 0.221152
H 0.121871 3.419058 0.641872
H -2.201758 -0.641328 -2.354890
H -3.567294 0.503333 -2.426307
H 0.095174 -3.491013 1.397410
H -0.924374 -2.064994 1.136386
H 3.859347 -1.700245 -1.581273
H 3.103626 -0.122976 -1.866774
H -0.419337 5.161278 2.374463
H -0.489437 3.532519 3.106643
H -2.000136 4.387071 2.687201
H -4.368997 -1.883441 -2.668869
H -5.014964 -1.173193 -1.159812
H -3.632257 -2.304589 -1.098249
H 0.119005 -3.011568 3.904630
H -1.549698 -3.210105 3.297140
H -0.908255 -1.576113 3.632036
H 5.061499 1.034044 -0.717902
H 5.606190 0.055935 -2.110978
H 5.832680 -0.553822 -0.446659


