%chk=000287844.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287844

0 1
O 3.618748 2.108003 -0.399931
N -0.257775 1.793236 0.625495
N -3.115901 1.229428 0.145215
N 0.937873 0.950234 -1.293898
C -1.121490 1.220133 1.711942
C -1.043283 2.591572 -0.358162
C -2.614840 1.550237 1.508344
C -2.249194 1.820431 -0.928730
C 0.758119 0.922041 0.127461
C -3.584943 -0.102120 -0.095852
C 1.499639 0.150219 0.974705
C 2.646528 -0.676954 0.625722
C 3.583009 -0.342385 -0.373937
C 3.459211 0.925102 -1.181876
C -3.792137 -1.022514 0.954501
C -3.975228 -0.462524 -1.407481
C 2.090923 0.930512 -1.866142
C 2.840963 -1.872058 1.360040
C 4.671175 -1.194540 -0.633198
C -4.372517 -2.264211 0.694110
C -4.549407 -1.709187 -1.647012
C -4.750234 -2.619002 -0.603190
C 3.919115 -2.706679 1.093833
C 4.841819 -2.369690 0.091164
H -0.764154 1.659846 2.670459
H -0.996287 0.115895 1.786344
H -0.389977 2.936404 -1.190481
H -1.373512 3.515023 0.171694
H -3.224652 1.022309 2.276179
H -2.801009 2.637709 1.672315
H -2.893967 2.509669 -1.518666
H -1.872753 1.036027 -1.627235
H 1.221412 0.094445 2.030030
H 4.280871 1.040700 -1.931237
H -3.510840 -0.771578 1.974144
H -3.850298 0.233116 -2.232885
H 2.114183 0.902282 -2.967580
H 2.125309 -2.142337 2.135138
H 5.393218 -0.927314 -1.405068
H -4.528358 -2.964674 1.514228
H -4.847318 -1.976112 -2.660935
H -5.196657 -3.588970 -0.799967
H 4.051509 -3.626608 1.662446
H 5.686725 -3.023676 -0.112588
H 3.134683 2.038359 0.457644


%chk=000287844-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287844

0 1
O 3.212235 2.437835 0.769776
N -0.133151 0.394930 -0.114848
N -3.019178 0.055036 -0.042740
N 1.719317 0.971823 -1.443223
C -0.788070 -0.318775 0.993209
C -1.014058 1.083737 -1.079988
C -2.233097 0.176590 1.195880
C -2.302059 0.275255 -1.315924
C 1.248047 0.313966 -0.296248
C -4.404949 -0.172589 -0.021975
C 2.062549 -0.512141 0.504918
C 3.512215 -0.644878 0.450329
C 4.412151 0.382643 -0.012553
C 3.855034 1.748054 -0.367705
C -5.162627 -0.067339 1.186758
C -5.106220 -0.518482 -1.220354
C 2.891324 1.541998 -1.531970
C 4.100369 -1.866331 0.918310
C 5.807140 0.140969 -0.067776
C -6.551515 -0.308605 1.189382
C -6.496687 -0.747470 -1.201042
C -7.236534 -0.649579 0.000196
C 5.485714 -2.084221 0.876499
C 6.353124 -1.081624 0.366688
H -0.219797 -0.152073 1.931099
H -0.799975 -1.415196 0.805003
H -0.454939 1.200851 -2.022615
H -1.275461 2.099061 -0.716968
H -2.688789 -0.454103 1.980278
H -2.218825 1.220902 1.580187
H -2.947910 0.851657 -2.006789
H -2.052083 -0.685437 -1.816595
H 1.555103 -1.262924 1.120776
H 4.662275 2.431734 -0.674759
H -4.678668 0.233561 2.121103
H -4.562762 -0.636104 -2.162889
H 3.212081 1.871951 -2.531059
H 3.437042 -2.657021 1.290013
H 6.468900 0.939320 -0.425414
H -7.104742 -0.214932 2.131441
H -7.003686 -1.015618 -2.135567
H -8.316056 -0.831164 0.008866
H 5.898453 -3.035071 1.232120
H 7.434928 -1.248487 0.335113
H 2.642138 1.778088 1.248157


