%chk=000200685.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200685

0 1
O -0.457295 -0.105893 -0.449625
O 0.624349 -0.721999 1.431891
O 0.970770 0.666403 -2.512190
O 1.896268 -2.895530 0.699274
N -4.414757 -0.174948 -0.532134
C -3.952204 -0.880941 0.717712
C -3.927603 1.229105 -0.281284
C -4.210561 0.114571 1.888188
C -4.192941 1.509236 1.228132
C -2.441348 -1.127781 0.515356
C -2.412426 1.201228 -0.590154
C -1.694316 0.195397 0.317080
C -5.885604 -0.256825 -0.743221
C 0.633566 -0.571030 0.231098
C 1.807423 -0.838291 -0.717768
C 1.391196 -0.658603 -2.203007
C 2.241956 -2.331250 -0.559646
C 2.940323 0.077326 -0.275578
C 3.402244 1.133820 -1.068553
C 3.538393 -0.150772 0.978386
C 4.464970 1.931554 -0.628747
C 4.595644 0.646475 1.414742
C 5.066977 1.688646 0.607289
H -4.482106 -1.844270 0.864557
H -4.436739 1.963926 -0.938038
H -3.450231 0.022566 2.678489
H -5.179980 -0.089802 2.368023
H -5.153953 2.028826 1.364858
H -3.424463 2.162564 1.666740
H -2.015149 -1.686104 1.369392
H -2.295145 -1.770286 -0.378850
H -2.269553 0.904970 -1.652393
H -1.974293 2.207953 -0.483140
H -1.377312 0.642896 1.282963
H -6.160944 -1.311578 -0.907404
H -6.142884 0.290455 -1.664708
H -6.499501 0.138284 0.079089
H 0.573669 -1.360518 -2.458845
H 2.255626 -0.813154 -2.877802
H 3.334503 -2.429679 -0.709501
H 1.710548 -2.995492 -1.270069
H 2.926801 1.359632 -2.029321
H 3.157716 -0.947993 1.624711
H 0.146750 0.893333 -2.004279
H 2.108445 -2.274243 1.448185
H 4.818311 2.748451 -1.256670
H 5.051563 0.460541 2.386018
H 5.894397 2.309323 0.945854


%chk=000200685-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200685

0 1
O -0.274506 -0.219158 -0.391188
O 0.387256 -1.738109 1.239393
O 0.982828 -0.404164 -2.842218
O 2.087416 -3.618435 -0.060746
N -4.370586 0.495488 -0.492480
C -4.032463 -0.771425 0.234533
C -3.605475 1.507142 0.306535
C -4.156489 -0.413646 1.763100
C -3.870034 1.126488 1.811810
C -2.580923 -1.155224 -0.157724
C -2.109057 1.365172 -0.079254
C -1.611942 -0.041902 0.289568
C -5.824534 0.770442 -0.576847
C 0.641913 -1.090164 0.190904
C 1.964819 -1.149350 -0.597265
C 1.673707 -1.456458 -2.104125
C 2.805162 -2.346093 -0.024383
C 2.754190 0.157405 -0.359379
C 3.306526 0.914922 -1.422712
C 2.988057 0.584477 0.976327
C 4.085612 2.063059 -1.151776
C 3.758917 1.735401 1.244712
C 4.317529 2.477850 0.178871
H -4.720856 -1.578449 -0.069484
H -3.952055 2.525295 0.060165
H -3.449116 -0.996523 2.379350
H -5.172481 -0.639454 2.131631
H -4.741181 1.680387 2.203310
H -3.008700 1.376364 2.457018
H -2.291129 -2.116415 0.303638
H -2.537805 -1.260199 -1.256888
H -2.018795 1.516447 -1.169754
H -1.495339 2.130658 0.429982
H -1.415104 -0.125876 1.373708
H -6.307458 -0.025504 -1.170859
H -5.980041 1.726794 -1.106777
H -6.349097 0.832019 0.406825
H 1.124251 -2.417448 -2.159865
H 2.639934 -1.591365 -2.622003
H 3.135222 -2.104903 1.004094
H 3.695511 -2.486003 -0.659859
H 3.098017 0.634200 -2.458063
H 2.558761 0.019304 1.813702
H 0.228883 -0.085220 -2.276880
H 1.391602 -3.576536 0.647269
H 4.503749 2.639428 -1.984846
H 3.926533 2.049582 2.281119
H 4.919871 3.370202 0.382912


