%chk=000219807.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219807

0 1
O 5.990428 0.019924 -0.036573
O -3.320011 2.784581 0.267388
O -1.279935 2.304851 -0.246694
N 0.487751 -0.768408 0.203628
N -2.435342 1.988258 -0.001105
C -1.833829 -0.453869 -0.251065
C -2.795971 0.555498 -0.040017
C -2.253697 -1.793803 -0.259662
C 1.881036 -0.483966 0.077358
C -4.149988 0.224000 0.156318
C -0.402155 -0.125861 -0.480997
C -3.597339 -2.119144 -0.068777
C -4.547691 -1.110178 0.136327
C 2.395079 0.806422 -0.150365
C 2.757048 -1.575419 0.283830
C 3.773954 1.014498 -0.191116
C 4.131107 -1.384234 0.233711
C 4.621890 -0.086268 -0.004341
H -1.509626 -2.582594 -0.401164
H -0.227302 0.669198 -1.230117
H -4.880400 1.024468 0.326417
H -3.908663 -3.165820 -0.075266
H -5.596512 -1.368496 0.285562
H 1.717534 1.653873 -0.277442
H 2.342666 -2.566318 0.481247
H 4.173967 2.009620 -0.359861
H 4.831425 -2.204673 0.379983
H 6.289474 0.949259 -0.195308


%chk=000219807-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219807

0 1
O 6.112871 -0.087409 -0.183433
O -3.759311 2.748667 -0.810709
O -1.621046 2.624697 -0.052912
N 0.520769 -0.849988 0.071542
N -2.752931 2.074596 -0.359137
C -1.827727 -0.294763 -0.019247
C -2.927789 0.611420 -0.164709
C -2.159322 -1.666247 0.195578
C 1.904543 -0.554698 0.006270
C -4.272495 0.167057 -0.115394
C -0.398263 0.070039 -0.129126
C -3.489217 -2.111012 0.264557
C -4.557028 -1.190783 0.103751
C 2.474341 0.749795 0.115482
C 2.781803 -1.668937 -0.137576
C 3.867422 0.928745 0.060431
C 4.172766 -1.497526 -0.213566
C 4.717691 -0.194349 -0.116265
H -1.317682 -2.357448 0.299344
H -0.166532 1.110710 -0.395301
H -5.069038 0.903917 -0.244737
H -3.700572 -3.171474 0.438221
H -5.596714 -1.529295 0.152590
H 1.832729 1.623408 0.275366
H 2.335737 -2.666383 -0.196953
H 4.294654 1.934756 0.163670
H 4.850083 -2.347208 -0.336263
H 6.405156 0.855112 -0.109577


