%chk=000208870.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208870

0 1
O 2.830062 1.561619 -0.095048
O 0.899643 1.875508 -1.016776
N 1.625879 1.389855 -0.169154
C 0.523542 -0.843946 0.321473
C -0.764754 -0.679312 -0.506916
C 1.611083 -1.548092 -0.514047
C -1.995893 -0.431534 0.373542
C 0.997528 0.515076 0.888309
C -3.258401 -0.231014 -0.477306
C 2.920361 -1.743329 0.242644
C -4.492076 0.004362 0.390672
H 0.300314 -1.488335 1.211636
H -0.644075 0.155416 -1.231722
H -0.930448 -1.582556 -1.126016
H 1.801332 -0.989042 -1.452471
H 1.223966 -2.535956 -0.839315
H -2.144681 -1.280477 1.068222
H -1.835391 0.459551 1.011494
H 1.740850 0.350290 1.700699
H 0.131287 1.058704 1.330411
H -3.420749 -1.113574 -1.126568
H -3.115517 0.626768 -1.164733
H 3.438241 -0.788478 0.414237
H 2.768864 -2.223454 1.214856
H 3.611664 -2.375845 -0.328358
H -4.383203 0.898414 1.015134
H -5.387288 0.145338 -0.226159
H -4.685738 -0.842159 1.058959


%chk=000208870-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208870

0 1
O 2.540155 1.586516 -0.404758
O 0.365306 2.271836 -0.346400
N 1.330700 1.506948 0.034513
C 0.577596 -0.907039 0.314549
C -0.737997 -0.750596 -0.495168
C 1.704661 -1.523475 -0.558264
C -1.964762 -0.281631 0.320138
C 1.011194 0.405247 1.030654
C -3.277064 -0.349095 -0.495126
C 3.014197 -1.841426 0.195152
C -4.504433 0.141942 0.302160
H 0.378843 -1.607154 1.156329
H -0.575712 -0.054240 -1.342083
H -0.965386 -1.738720 -0.945207
H 1.925029 -0.849484 -1.409179
H 1.300834 -2.456842 -0.998217
H -2.070643 -0.908079 1.231598
H -1.814935 0.762476 0.658634
H 1.927756 0.248714 1.619639
H 0.201738 0.791921 1.668222
H -3.445696 -1.392440 -0.832285
H -3.163115 0.261636 -1.413396
H 3.540428 -0.919256 0.498523
H 2.823062 -2.451870 1.098937
H 3.704723 -2.411528 -0.452128
H -4.375013 1.193850 0.619089
H -5.428538 0.082892 -0.301561
H -4.656528 -0.467306 1.213332


