%chk=000234709.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234709

0 1
O 0.163743 -3.202392 -0.309740
O 4.061893 1.765996 -0.837662
N -2.081473 -1.422619 1.147917
C -2.708353 -2.068574 -0.043461
C -2.426273 -1.327701 -1.357096
C -2.925349 0.117153 -1.267862
C -2.146062 0.017246 1.158373
C -2.577260 0.770202 0.040468
C -0.759018 -1.997481 1.515043
C -1.864559 0.674891 2.374435
C -2.705594 2.160614 0.162806
C 0.216700 -2.176417 0.343410
C -1.996177 2.058928 2.471764
C -2.412849 2.806149 1.365630
C 1.219116 -1.128596 0.045732
C 1.215603 0.142235 0.653371
C 2.213778 -1.434093 -0.902650
C 2.181314 1.084761 0.331858
C 3.198541 -0.508317 -1.242098
C 3.171617 0.747996 -0.617928
C 5.129383 1.548074 -1.794557
H -3.803908 -2.089960 0.159896
H -2.371640 -3.127121 -0.116431
H -2.912587 -1.852671 -2.200083
H -1.341146 -1.345888 -1.582408
H -4.029406 0.142218 -1.394398
H -2.511575 0.706554 -2.111625
H -0.297160 -1.411480 2.337163
H -0.962417 -3.011092 1.945137
H -1.571063 0.094868 3.247892
H -3.035614 2.747227 -0.693836
H -1.780469 2.557576 3.415240
H -2.513639 3.885995 1.442697
H 0.442763 0.402216 1.382402
H 2.204611 -2.422190 -1.377769
H 2.190264 2.072862 0.787432
H 3.957675 -0.765428 -1.972485
H 4.714943 1.368462 -2.790669
H 5.773945 0.728707 -1.463788
H 5.661602 2.508088 -1.756524


%chk=000234709-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234709

0 1
O 0.787465 -3.525842 0.602219
O 4.363110 1.535633 -1.223504
N -1.610983 -1.006280 0.592413
C -2.157830 -1.707887 -0.590272
C -2.612988 -0.712971 -1.669199
C -3.673922 0.233507 -1.075780
C -2.184103 0.209948 1.026631
C -3.187058 0.861407 0.225491
C -0.736143 -1.832557 1.433044
C -1.779258 0.849493 2.239320
C -3.723389 2.093670 0.654025
C 0.564052 -2.280339 0.718667
C -2.343927 2.075320 2.647672
C -3.323632 2.714973 1.858457
C 1.527678 -1.266798 0.202090
C 1.362573 0.139260 0.378871
C 2.685972 -1.731829 -0.478724
C 2.323660 1.038916 -0.104596
C 3.656155 -0.842166 -0.971991
C 3.473541 0.554509 -0.782663
C 5.575948 1.101210 -1.927326
H -3.012364 -2.357949 -0.291560
H -1.371111 -2.372427 -0.990794
H -3.023396 -1.270867 -2.530925
H -1.738826 -0.135470 -2.023905
H -4.605553 -0.341334 -0.891379
H -3.936261 1.027997 -1.798962
H -0.462308 -1.294910 2.354392
H -1.247519 -2.769254 1.737827
H -1.029141 0.393952 2.893196
H -4.479820 2.575659 0.020704
H -2.009556 2.527566 3.588542
H -3.761529 3.669076 2.168493
H 0.480297 0.538907 0.886065
H 2.804935 -2.813381 -0.605084
H 2.208823 2.119158 0.024082
H 4.536567 -1.232266 -1.491126
H 5.325343 0.559421 -2.859292
H 6.206298 0.461944 -1.280234
H 6.112099 2.030000 -2.169289


