%chk=000258703.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258703

0 1
O 0.596490 1.714126 -0.466539
O 4.162273 -0.850195 0.419027
N -0.540025 -0.274141 -0.121920
N 1.505160 0.195757 1.037672
C -1.766014 0.245020 -0.803205
C -2.512572 -0.942389 -1.443548
C -2.674043 1.033453 0.163983
C -3.234886 -1.824103 -0.417285
C -3.378741 0.134130 1.184713
C -4.151903 -0.996355 0.492751
C 0.523369 0.630926 0.098594
C 2.786269 0.945300 1.043691
C 3.762336 0.466026 -0.038853
C 5.021644 -1.542480 -0.502995
H -1.416650 0.944281 -1.614305
H -1.804441 -1.554841 -2.035400
H -3.246372 -0.539283 -2.169028
H -3.427487 1.585928 -0.430518
H -2.078435 1.810228 0.683364
H -2.497087 -2.377302 0.194030
H -3.826831 -2.596778 -0.944284
H -4.069855 0.740775 1.800692
H -2.640411 -0.289032 1.891726
H -4.982552 -0.570025 -0.102387
H -4.623252 -1.650489 1.249549
H -0.720357 -0.999338 0.571683
H 1.646242 -0.813272 1.148769
H 3.241520 0.807925 2.052750
H 2.578825 2.034455 0.907275
H 4.653875 1.112516 -0.102917
H 3.287445 0.388057 -1.032233
H 5.953716 -0.989483 -0.651228
H 4.508726 -1.715512 -1.453661
H 5.213322 -2.491286 0.013435


%chk=000258703-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258703

0 1
O 0.333112 2.015703 -0.372194
O 4.124938 -0.982315 0.490875
N -0.658454 -0.100988 -0.283674
N 1.554181 0.195602 0.460854
C -1.951358 0.376362 -0.821356
C -2.718603 -0.799630 -1.474595
C -2.819464 1.057393 0.274604
C -3.258676 -1.815376 -0.434620
C -3.339038 0.042631 1.319212
C -4.119296 -1.111164 0.643237
C 0.404755 0.776672 -0.080872
C 2.759826 0.982912 0.721502
C 3.972780 0.396561 -0.004614
C 5.231388 -1.689686 -0.148132
H -1.705130 1.134680 -1.586980
H -2.069936 -1.303892 -2.216761
H -3.578163 -0.374671 -2.029661
H -3.681423 1.549207 -0.222013
H -2.222270 1.854859 0.752218
H -2.418084 -2.348419 0.060511
H -3.850213 -2.595872 -0.951031
H -3.982611 0.557068 2.058439
H -2.480402 -0.374803 1.884726
H -5.030577 -0.698438 0.162107
H -4.459850 -1.844208 1.400158
H -0.594031 -1.067258 0.038237
H 1.636808 -0.814038 0.590857
H 2.976993 1.017143 1.807673
H 2.558292 2.011349 0.374160
H 4.886945 0.988166 0.222611
H 3.807610 0.389359 -1.103812
H 6.201442 -1.184872 0.046824
H 5.085434 -1.768014 -1.246781
H 5.252374 -2.699424 0.291690


