%chk=000217064.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217064

0 1
O 1.265712 -2.277157 -0.132024
O 1.278655 2.318692 -0.006719
N -1.237969 0.054549 -0.854261
N 1.348137 0.018272 -0.037914
N -2.597360 -0.013418 -1.259397
C -0.878330 -1.138831 -0.000344
C -0.864580 1.187207 0.078324
C -1.290948 -0.793049 1.452528
C -1.271711 0.749089 1.507838
C 0.656437 -1.234505 -0.082487
C 0.671617 1.272030 -0.007382
C 2.829947 0.015356 -0.153207
H -1.341343 -2.077549 -0.384423
H -1.303796 2.159616 -0.229371
H -0.613776 -1.245558 2.196339
H -2.296753 -1.193231 1.669930
H -2.259370 1.157370 1.778820
H -0.568727 1.126999 2.270477
H -3.245736 0.485024 -0.645575
H -2.656515 0.410551 -2.192675
H 3.137974 0.049117 -1.212229
H 3.243102 -0.903923 0.299502
H 3.253434 0.896551 0.360753


%chk=000217064-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217064

0 1
O 1.301996 -2.320148 -0.104093
O 1.337995 2.357321 -0.012464
N -1.250176 0.058177 -0.860028
N 1.376693 0.018494 -0.071377
N -2.644227 0.031344 -1.181356
C -0.841953 -1.122713 -0.034521
C -0.820452 1.184951 0.039463
C -1.314845 -0.794736 1.432600
C -1.284095 0.767340 1.489466
C 0.683308 -1.224065 -0.086646
C 0.705379 1.268165 -0.027069
C 2.856240 0.010531 -0.132372
H -1.269770 -2.045715 -0.445108
H -1.225018 2.148910 -0.300159
H -0.666715 -1.264131 2.190910
H -2.336971 -1.184990 1.577714
H -2.284493 1.185715 1.700934
H -0.599116 1.154918 2.261593
H -3.295696 0.357468 -0.452769
H -2.823271 0.410518 -2.113038
H 3.199535 0.077462 -1.179376
H 3.217040 -0.933025 0.302576
H 3.236713 0.881410 0.421623


