%chk=000242366.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242366

0 1
O -3.202273 -5.122271 -0.415789
O -1.812767 -5.530817 1.188377
N -1.460672 3.478687 -1.249483
N 2.864837 1.193437 1.889943
N -2.251802 -4.825097 0.292266
C 0.332451 0.254318 -0.710941
C -0.618119 1.413210 -0.730164
C 1.512171 0.553461 0.159402
C -1.872668 1.575127 -0.031584
C 2.887707 0.429185 -0.271338
C -0.344501 -1.068590 -0.397226
C -0.387017 2.582497 -1.452701
C 1.523777 1.018916 1.470878
C -2.383489 2.873911 -0.375888
C 3.717138 0.838608 0.826454
C -2.621311 0.775281 0.852445
C 3.500759 0.013142 -1.466224
C 0.755313 2.942722 -2.317676
C 0.406462 1.314918 2.388109
C -1.455716 -1.457262 -1.173458
C 0.135254 -1.934528 0.598100
C -3.601389 3.365489 0.130468
C 5.121398 0.842390 0.745068
C -3.818496 1.261024 1.352079
C 4.884819 0.017696 -1.544798
C -4.305599 2.543379 0.993466
C 5.686467 0.428718 -0.450574
C -2.082543 -2.678562 -0.954169
C -0.482517 -3.162513 0.827742
C -1.592812 -3.530069 0.052085
H 0.726185 0.133502 -1.768767
H -1.549891 4.388765 -1.656350
H 3.159301 1.527126 2.786868
H -2.259844 -0.212788 1.131851
H 2.891995 -0.311462 -2.306491
H 1.700781 2.552347 -1.895200
H 0.649584 2.510600 -3.324833
H 0.888752 4.026021 -2.436060
H 0.720301 1.632949 3.389123
H -0.236211 2.114936 1.972851
H -0.249233 0.436070 2.509801
H -1.837110 -0.782118 -1.942577
H 1.008543 -1.653163 1.191863
H -3.967302 4.347365 -0.149152
H 5.730576 1.155053 1.586141
H -4.409674 0.651950 2.033717
H 5.378393 -0.302818 -2.460312
H -5.254453 2.878143 1.410430
H 6.769877 0.413394 -0.561271
H -2.948360 -2.985280 -1.550380
H -0.111870 -3.842599 1.601980


%chk=000242366-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242366

0 1
O -2.931422 -5.272143 -0.832956
O -1.525916 -5.689218 0.914254
N -1.725103 3.486572 -1.222097
N 2.967449 1.381285 1.840982
N -1.986055 -4.924765 -0.021702
C 0.331949 0.397697 -0.674675
C -0.721700 1.505231 -0.690251
C 1.546526 0.688908 0.196589
C -1.974072 1.603722 0.048344
C 2.902714 0.297668 -0.158105
C -0.278856 -1.002364 -0.459480
C -0.602007 2.673677 -1.455943
C 1.619416 1.348079 1.432988
C -2.581738 2.861221 -0.309703
C 3.777221 0.752084 0.890540
C -2.648446 0.776232 0.989965
C 3.465238 -0.392247 -1.265576
C 0.482526 3.115861 -2.398010
C 0.562398 1.979196 2.297661
C -1.323781 -1.440950 -1.319146
C 0.193702 -1.887843 0.541178
C -3.811795 3.298920 0.225993
C 5.172779 0.545101 0.860195
C -3.875604 1.207417 1.530400
C 4.858099 -0.601929 -1.304399
C -4.454822 2.454446 1.153858
C 5.703903 -0.137949 -0.253952
C -1.888493 -2.720265 -1.187639
C -0.360425 -3.174479 0.694751
C -1.398206 -3.575274 -0.173424
H 0.726924 0.358664 -1.714337
H -1.885916 4.391547 -1.659427
H 3.291776 1.812276 2.704380
H -2.229832 -0.190269 1.287309
H 2.829795 -0.769062 -2.075666
H 1.373719 2.477153 -2.290680
H 0.157492 3.073231 -3.456111
H 0.801814 4.155008 -2.190356
H 0.985841 2.325932 3.257851
H 0.095372 2.845533 1.795758
H -0.256208 1.275147 2.525445
H -1.703605 -0.757832 -2.086957
H 1.007280 -1.563842 1.197424
H -4.255200 4.258356 -0.064075
H 5.825369 0.897125 1.667181
H -4.400341 0.570967 2.251536
H 5.303305 -1.134738 -2.152008
H -5.412508 2.758876 1.590291
H 6.782951 -0.318704 -0.312180
H -2.693075 -3.068024 -1.840562
H -0.005229 -3.866835 1.462646


