%chk=000267526.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267526

0 1
O 7.418853 0.935520 0.366240
O 1.995741 -0.705610 2.136212
O 6.857926 -1.212800 0.637544
N 1.422315 -1.501297 0.077515
C 1.605832 -0.186185 -0.587720
C 0.509622 0.025878 -1.658517
C 3.003432 -0.089539 -1.242179
C -0.876471 -0.010606 -1.071642
C -1.399970 1.146037 -0.357158
C 4.122805 -0.233721 -0.205238
C -2.699008 1.084783 0.205031
C -1.637479 -1.131801 -1.214817
C -3.501155 -0.123009 0.054772
C -2.967259 -1.220052 -0.659200
C 5.463684 0.262749 -0.758647
C -0.643288 2.340077 -0.210375
C -3.199980 2.214274 0.908018
C -4.808081 -0.235940 0.600795
C -3.741425 -2.401096 -0.820705
C -1.151084 3.425277 0.476119
C -2.443587 3.360828 1.043835
C 1.610831 -1.641328 1.454637
C -5.547159 -1.391021 0.437233
C -5.009621 -2.484317 -0.281464
C 6.590472 -0.144881 0.142198
H 1.516846 0.610101 0.207845
H 0.679087 0.998238 -2.168625
H 0.609551 -0.729504 -2.464718
H 3.118394 -0.860069 -2.027661
H 3.086745 0.886634 -1.758870
H 4.213577 -1.295347 0.109689
H 3.862078 0.318491 0.725112
H -1.266020 -2.000072 -1.756546
H 1.100015 -2.270258 -0.495976
H 5.653612 -0.159628 -1.769992
H 5.451393 1.367591 -0.888908
H 0.353910 2.399390 -0.645712
H -4.198778 2.164617 1.345363
H -5.225288 0.606101 1.155969
H -3.321793 -3.238036 -1.375772
H -0.562797 4.334538 0.588809
H -2.832549 4.220924 1.586933
H 1.400497 -2.647132 1.849336
H -6.547783 -1.471252 0.858527
H -5.606149 -3.387079 -0.402756
H 8.185906 0.718129 0.959166


%chk=000267526-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267526

0 1
O 7.878567 0.554550 -0.199475
O 1.856068 -0.550397 2.384000
O 6.799058 -1.220540 0.833965
N 1.486920 -1.381056 0.222954
C 1.644922 -0.094689 -0.485262
C 0.529322 0.068988 -1.564322
C 3.047727 0.050998 -1.135266
C -0.892787 0.028436 -1.028604
C -1.468943 1.166678 -0.317284
C 4.216140 -0.129914 -0.143441
C -2.812119 1.082967 0.211965
C -1.661606 -1.109846 -1.211116
C -3.594415 -0.143213 0.028344
C -3.004188 -1.237652 -0.698556
C 5.575276 0.171724 -0.812071
C -0.732552 2.380869 -0.138178
C -3.343343 2.217934 0.898426
C -4.921931 -0.310412 0.530363
C -3.749479 -2.439790 -0.904081
C -1.280926 3.477519 0.536413
C -2.599029 3.392633 1.063206
C 1.574761 -1.497537 1.598086
C -5.636713 -1.498301 0.321968
C -5.049065 -2.574557 -0.402808
C 6.757077 -0.260009 0.035130
H 1.535358 0.679601 0.296383
H 0.724585 1.017473 -2.100573
H 0.655967 -0.736877 -2.315334
H 3.146838 -0.680576 -1.965958
H 3.101062 1.058984 -1.597471
H 4.226510 -1.162488 0.248716
H 4.070496 0.529292 0.732670
H -1.247542 -1.959680 -1.770638
H 1.225408 -2.208105 -0.319438
H 5.651844 -0.382815 -1.771205
H 5.685466 1.241621 -1.060753
H 0.280716 2.461156 -0.543179
H -4.357127 2.180136 1.307390
H -5.402087 0.496418 1.091945
H -3.284528 -3.260847 -1.463094
H -0.697881 4.396281 0.661063
H -3.032625 4.246028 1.595666
H 1.370598 -2.535417 1.948261
H -6.652834 -1.599678 0.718660
H -5.613305 -3.499530 -0.563383
H 8.640741 0.222236 0.349619


