%chk=000213177.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213177

0 1
O -1.718709 -0.882603 1.029030
O 3.430130 -1.448810 1.290085
O 3.122477 0.068782 -2.425607
O 0.884802 -0.146296 -2.324751
O -3.247382 0.798329 1.385236
N 2.182827 -0.693286 -0.446943
N -3.551106 -0.824910 -0.269255
C 0.442318 0.245708 1.191814
C 0.073071 1.415876 0.255307
C 0.946189 -0.971521 0.356776
C -0.795460 -0.265270 1.974481
C 1.495231 0.671261 2.223123
C -0.595263 2.605464 0.956497
C -0.779618 3.782419 0.000253
C 3.463524 -0.930446 0.197207
C 1.950932 -0.250160 -1.756669
C 4.706903 -0.525057 -0.545500
C -2.894603 -0.184728 0.762586
C -4.867420 -0.326706 -0.771488
C 5.951621 -0.758539 0.299167
C -5.918913 -1.425595 -0.593165
C -4.720098 0.083227 -2.239343
H 0.986119 1.768775 -0.261590
H -0.593134 1.041169 -0.550512
H 0.130663 -1.305410 -0.330385
H 1.170659 -1.827604 1.036538
H -1.303003 0.542795 2.534259
H -0.555296 -1.099691 2.656326
H 2.321930 1.211116 1.747553
H 1.078121 1.338724 2.984722
H 1.939909 -0.193218 2.735965
H -1.588148 2.299750 1.357524
H 0.004306 2.925442 1.829317
H -1.386701 3.501372 -0.868295
H 0.178295 4.158026 -0.374029
H -1.290634 4.614559 0.497790
H 4.640478 0.543766 -0.855897
H 4.775914 -1.089352 -1.505602
H -3.132732 -1.634540 -0.717750
H -5.152772 0.572313 -0.155241
H 6.038812 -1.809735 0.608543
H 5.933787 -0.162111 1.221368
H 6.860330 -0.494591 -0.253879
H 2.920352 0.367862 -3.358700
H -6.003535 -1.731055 0.457768
H -5.689157 -2.324157 -1.176128
H -6.907500 -1.074984 -0.911773
H -4.449060 -0.759195 -2.885294
H -5.656917 0.501562 -2.624818
H -3.943539 0.849573 -2.364320


%chk=000213177-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213177

0 1
O -1.732916 -0.870925 0.760632
O 3.510116 -1.521071 1.297229
O 3.396124 0.194815 -2.463037
O 1.108260 -0.154883 -2.449224
O -3.361363 0.707407 1.447215
N 2.360936 -0.600259 -0.499814
N -3.724286 -0.800156 -0.322786
C 0.488774 0.241690 1.077196
C 0.128977 1.459195 0.171276
C 1.086273 -0.926135 0.221041
C -0.772975 -0.347221 1.764134
C 1.459344 0.658962 2.214054
C -0.506305 2.681567 0.877135
C -0.819781 3.812846 -0.127568
C 3.594179 -0.923631 0.191588
C 2.201575 -0.189768 -1.832842
C 4.947553 -0.534755 -0.397191
C -2.992754 -0.228959 0.688712
C -5.098405 -0.373798 -0.661569
C 6.101411 -0.863827 0.566629
C -6.090702 -1.544613 -0.476393
C -5.150366 0.206327 -2.093578
H 1.058582 1.799064 -0.330844
H -0.544905 1.115099 -0.637457
H 0.346196 -1.229334 -0.535190
H 1.310010 -1.781065 0.880259
H -1.287288 0.409755 2.380978
H -0.499709 -1.213344 2.394195
H 2.343870 1.177936 1.801606
H 0.967531 1.352341 2.919753
H 1.822351 -0.218313 2.776775
H -1.444100 2.383712 1.382674
H 0.177431 3.069871 1.657113
H -1.536228 3.467684 -0.896690
H 0.095757 4.151885 -0.649827
H -1.265606 4.688196 0.379494
H 4.934445 0.539090 -0.656618
H 5.084798 -1.052196 -1.364402
H -3.280345 -1.545593 -0.862560
H -5.340931 0.425236 0.061354
H 6.130331 -1.940634 0.803104
H 5.993224 -0.322898 1.522219
H 7.064052 -0.576695 0.106697
H 3.160135 0.448062 -3.394374
H -6.049444 -1.933931 0.555665
H -5.860190 -2.374681 -1.171820
H -7.123357 -1.209619 -0.682603
H -4.882613 -0.562192 -2.843984
H -6.169143 0.565464 -2.326750
H -4.449529 1.052591 -2.199302


