%chk=000181234.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181234

0 1
O -0.577636 1.449612 -0.475758
O 5.222062 -0.116475 1.243863
N -0.667377 -2.528488 0.435490
C 0.623861 -0.559557 -0.070232
C -1.868842 -0.486055 -0.001661
C -0.601688 0.260468 -0.211959
C 1.940579 0.078146 -0.258798
C 0.555075 -1.891210 0.233260
C -1.863160 -1.812967 0.318727
C -3.148387 0.231443 -0.144266
C 3.008927 -0.267861 0.578097
C 2.136401 1.018721 -1.289708
C -0.715790 -3.967350 0.776382
C -3.301244 1.523154 0.389539
C -4.229691 -0.372480 -0.810547
C 4.264374 0.327084 0.352700
C 3.390098 1.593093 -1.486463
C 4.479192 1.251598 -0.674573
C -4.524280 2.186973 0.278421
C -5.450176 0.299048 -0.918467
C -5.602897 1.575754 -0.369819
C 6.546731 0.458339 1.151093
H 1.457209 -2.510085 0.325902
H -2.789016 -2.371825 0.499811
H 2.892650 -0.954580 1.410099
H 1.288822 1.319672 -1.908320
H -1.212960 -4.123580 1.751508
H 0.297005 -4.400631 0.847332
H -1.267955 -4.535793 0.005649
H -2.449564 2.014154 0.866665
H -4.115388 -1.354394 -1.262179
H 3.529135 2.323144 -2.284575
H 5.447275 1.705377 -0.844345
H -4.634770 3.187749 0.693226
H -6.282748 -0.172426 -1.436862
H -6.554143 2.096092 -0.454090
H 7.071321 -0.049175 1.970515
H 6.505446 1.538083 1.322013
H 6.998751 0.216030 0.185230


%chk=000181234-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181234

0 1
O -0.609568 1.582757 -0.524356
O 5.345848 -0.296797 1.212975
N -0.664261 -2.469739 0.436718
C 0.622181 -0.462485 -0.070140
C -1.895548 -0.418121 -0.028820
C -0.624534 0.332701 -0.231357
C 1.967335 0.157766 -0.233161
C 0.541249 -1.814964 0.238802
C -1.852047 -1.764404 0.308779
C -3.220533 0.245434 -0.177277
C 3.060622 -0.296116 0.548075
C 2.193963 1.193468 -1.186230
C -0.706124 -3.907090 0.780337
C -3.416618 1.601817 0.207590
C -4.335816 -0.474985 -0.693961
C 4.354955 0.244396 0.370798
C 3.486804 1.724788 -1.353138
C 4.582834 1.261670 -0.586987
C -4.690935 2.199769 0.104939
C -5.608605 0.124821 -0.795950
C -5.793906 1.467351 -0.391768
C 6.696973 0.253791 1.099138
H 1.437121 -2.435902 0.320051
H -2.762418 -2.334429 0.514232
H 2.927101 -1.045216 1.335917
H 1.354294 1.580492 -1.765092
H -1.211259 -4.058162 1.750618
H 0.320486 -4.296459 0.856406
H -1.242238 -4.478034 0.001790
H -2.563337 2.179229 0.568517
H -4.198667 -1.502131 -1.054159
H 3.650046 2.518909 -2.090376
H 5.575404 1.698202 -0.732673
H -4.820817 3.244351 0.409666
H -6.449158 -0.447731 -1.204478
H -6.779683 1.938780 -0.475284
H 7.294373 -0.292381 1.844183
H 6.712836 1.337040 1.330049
H 7.118851 0.086418 0.088526


