%chk=000234675.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234675

0 1
O 0.006674 0.508233 0.783694
O 2.062658 2.566974 -0.240811
O -0.886004 -0.782489 -0.884020
N 3.310627 -1.131349 0.235532
N -2.215489 0.280077 0.752432
C 1.870532 -1.007576 0.615360
C 1.356805 0.379168 0.186320
C 4.033150 -2.095466 1.117260
C 3.464145 -1.445141 -1.224774
C 2.112571 1.558906 0.796049
C 3.531901 -3.541356 1.096447
C 4.884519 -1.114146 -1.683662
C 2.850237 3.747772 0.062648
C -1.035584 -0.079403 0.092265
C 2.641931 4.641380 -1.147592
C -3.527908 -0.146586 0.372679
C -4.605146 0.310756 1.159677
C -3.751621 -0.986425 -0.731525
C -5.902166 -0.082936 0.828300
C -5.058147 -1.365658 -1.041643
C -6.134930 -0.919480 -0.268188
H 1.757999 -1.113251 1.716665
H 1.217754 -1.788452 0.161394
H 1.261648 0.486259 -0.919439
H 5.107076 -2.065957 0.822904
H 3.987047 -1.694032 2.154293
H 3.219619 -2.502962 -1.463682
H 2.742082 -0.817496 -1.795647
H 1.614520 1.943439 1.704155
H 3.166953 1.294662 1.008571
H 4.147910 -4.179645 1.739246
H 3.565703 -3.967569 0.086740
H 2.498495 -3.624070 1.449646
H 4.962416 -1.164777 -2.774972
H 5.624850 -1.802624 -1.262482
H 5.169888 -0.099158 -1.375456
H 3.905594 3.450433 0.191866
H 2.469597 4.202493 0.993476
H -2.133313 0.910442 1.556092
H 2.985269 4.145868 -2.066023
H 1.575247 4.860712 -1.294364
H 3.178294 5.589642 -1.046090
H -4.438023 0.961621 2.013463
H -2.914498 -1.337631 -1.343555
H -6.739559 0.266983 1.431816
H -5.236744 -2.016673 -1.897970
H -7.148881 -1.220912 -0.518892


%chk=000234675-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234675

0 1
O 0.092388 0.532816 0.789944
O 1.935564 2.710962 -0.094945
O -0.727689 -0.691120 -1.054980
N 3.311764 -1.317085 0.105829
N -2.137260 0.278312 0.591395
C 2.053573 -0.976199 0.805418
C 1.484280 0.364132 0.276240
C 4.360462 -1.906716 0.975086
C 3.083307 -2.013751 -1.188708
C 2.281473 1.568316 0.752116
C 4.079457 -3.333328 1.522400
C 4.290251 -1.931563 -2.140956
C 2.635980 3.937961 0.307676
C -0.924157 -0.030645 -0.003007
C 2.204257 5.049108 -0.648831
C -3.441235 -0.094116 0.166075
C -4.535617 0.344466 0.959704
C -3.681705 -0.871477 -0.998009
C -5.855453 0.010188 0.595740
C -5.010041 -1.197626 -1.346936
C -6.102983 -0.764886 -0.561358
H 2.252387 -0.879267 1.890185
H 1.268692 -1.757028 0.686326
H 1.443199 0.353955 -0.827126
H 5.312247 -1.913018 0.412041
H 4.510848 -1.215325 1.827008
H 2.796866 -3.083779 -1.037621
H 2.212136 -1.533949 -1.671081
H 2.048545 1.786706 1.818600
H 3.361078 1.321952 0.654600
H 4.900277 -3.653495 2.191100
H 4.001833 -4.075385 0.707496
H 3.138415 -3.362981 2.102147
H 4.031433 -2.375182 -3.119901
H 5.168454 -2.477866 -1.751275
H 4.580779 -0.877854 -2.298647
H 3.737099 3.776733 0.260904
H 2.373842 4.192746 1.359772
H -2.063587 0.856421 1.431377
H 2.468971 4.786770 -1.687580
H 1.111670 5.196190 -0.598751
H 2.701353 6.001201 -0.387569
H -4.351824 0.946229 1.859170
H -2.839045 -1.203390 -1.607869
H -6.689364 0.356090 1.216609
H -5.188895 -1.796932 -2.246877
H -7.128329 -1.024693 -0.844728


