%chk=000214549.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214549

0 1
O -2.162762 0.257007 3.353102
N -4.503265 -0.495520 0.801057
N -1.738967 -0.611301 1.232985
N -0.410773 -0.290148 1.279169
C -6.453310 0.343347 -1.220805
C -5.243365 1.208789 -0.848961
C -6.144921 -1.134045 -0.949703
C -4.812056 0.961953 0.605208
C -5.701826 -1.351134 0.506693
C -4.014965 -0.740892 2.192465
C -2.558764 -0.282195 2.347057
C 3.961702 -0.133648 -0.788765
C 4.531923 0.425681 0.384528
C 1.773893 -0.187628 0.289610
C 2.565670 -0.435557 -0.814151
C 3.690567 0.673309 1.515439
C 0.333733 -0.511110 0.228252
C 2.353392 0.376897 1.471924
C 4.801780 -0.382539 -1.921812
C 5.930757 0.726915 0.406317
C 6.140124 -0.083915 -1.873097
C 6.712384 0.478133 -0.693911
H -7.341822 0.660745 -0.642572
H -6.713365 0.489127 -2.285819
H -4.398688 0.983030 -1.529974
H -5.475853 2.280847 -0.988289
H -7.030505 -1.760256 -1.163716
H -5.345222 -1.479374 -1.635101
H -3.887437 1.540420 0.825148
H -5.595783 1.330654 1.301675
H -6.550900 -1.149017 1.194639
H -5.408437 -2.413613 0.651010
H -4.615285 -0.235760 2.984347
H -4.055468 -1.830119 2.425070
H -2.188074 -0.967033 0.372153
H 2.146853 -0.864287 -1.722763
H 4.134643 1.102683 2.413090
H 1.705829 0.564094 2.333916
H -0.011735 -0.928323 -0.729149
H 4.356708 -0.811807 -2.817609
H 6.358038 1.155752 1.311515
H 6.786007 -0.269833 -2.729519
H 7.777247 0.704069 -0.686155


%chk=000214549-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000214549

0 1
O -2.302623 0.002294 3.892187
N -4.455359 -0.458318 0.934246
N -1.873637 -0.396455 1.597735
N -0.508981 -0.195496 1.648400
C -5.941181 0.156159 -1.533071
C -4.829212 1.086087 -0.996074
C -5.700784 -1.296170 -1.060038
C -4.701097 0.958955 0.534467
C -5.550143 -1.358158 0.473071
C -4.161132 -0.580189 2.384266
C -2.684029 -0.275191 2.726551
C 3.694664 -0.017027 -0.851370
C 4.436879 0.298220 0.353666
C 1.603041 -0.110069 0.464740
C 2.280505 -0.216519 -0.761964
C 3.722984 0.399493 1.598375
C 0.152561 -0.312918 0.513086
C 2.348642 0.203648 1.659453
C 4.401615 -0.117028 -2.095890
C 5.851634 0.499140 0.266059
C 5.783176 0.085400 -2.151349
C 6.514715 0.395762 -0.961122
H -6.925032 0.507009 -1.158576
H -5.983359 0.200575 -2.637441
H -3.861432 0.816093 -1.463323
H -5.039427 2.140297 -1.258183
H -6.535809 -1.952026 -1.371776
H -4.776014 -1.689953 -1.525712
H -3.860937 1.575128 0.905352
H -5.633142 1.343871 1.019743
H -6.523006 -1.077670 0.950340
H -5.308404 -2.388858 0.792741
H -4.788297 0.081109 3.021990
H -4.359093 -1.619909 2.708245
H -2.406686 -0.615312 0.727282
H 1.721097 -0.454842 -1.676683
H 4.285025 0.636951 2.509597
H 1.798433 0.280879 2.602063
H -0.350651 -0.562270 -0.443927
H 3.840310 -0.354746 -3.007817
H 6.410728 0.736928 1.179030
H 6.313514 0.007516 -3.106819
H 7.597647 0.552007 -1.017054


