%chk=000183422.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183422

0 1
I -2.526675 -1.222863 -2.877626
O -3.277000 0.825024 0.230164
O 0.682527 0.891063 1.710258
N -1.137769 1.362501 -0.406488
N 0.162574 0.858350 -0.530437
C -1.303602 2.871451 -0.174000
C -1.559072 3.110462 1.317871
C -0.038901 3.617639 -0.626447
C -2.498647 3.308806 -1.031655
C -2.148187 0.443692 -0.001123
C -1.751944 -1.006727 0.090115
C 1.012854 0.637144 0.566996
C 2.334940 0.059013 0.163680
C -1.880052 -1.892132 -0.977553
C -1.291501 -1.480960 1.328810
C -1.574405 -3.244854 -0.831121
C -0.979316 -2.833243 1.484623
C 3.505309 0.770234 0.456977
C 2.398235 -1.194397 -0.459156
C -1.124293 -3.714706 0.407712
C 4.745984 0.227810 0.109808
C 3.642607 -1.731577 -0.799712
C 4.814347 -1.020155 -0.518643
H -0.775491 2.649641 1.940482
H -1.590611 4.176806 1.556355
H -2.517814 2.676488 1.636935
H 0.229587 3.386190 -1.662369
H 0.824865 3.393271 0.009103
H -0.199670 4.701313 -0.570058
H -3.429379 2.809238 -0.712508
H -2.666143 4.386695 -0.950855
H -2.357010 3.063135 -2.089357
H 0.436504 0.668182 -1.498793
H -1.166126 -0.782634 2.163844
H -1.687790 -3.937130 -1.667427
H -0.624386 -3.199847 2.448346
H 3.446565 1.735603 0.961612
H 1.483961 -1.752667 -0.667023
H -0.889117 -4.771690 0.531970
H 5.660018 0.776443 0.334323
H 3.699384 -2.706352 -1.282587
H 5.783237 -1.441260 -0.786646


%chk=000183422-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183422

0 1
I -1.895432 -1.025630 -2.819912
O -3.242625 0.795350 0.683165
O 0.982190 1.194401 1.703329
N -1.135094 1.379746 -0.152389
N 0.145040 0.884886 -0.452508
C -1.402483 2.888778 -0.185050
C -1.703193 3.377329 1.256027
C -0.143534 3.606466 -0.721710
C -2.598464 3.153544 -1.136820
C -2.088152 0.458174 0.291184
C -1.667895 -1.002029 0.313274
C 1.139827 0.761091 0.524107
C 2.406358 0.097740 0.055704
C -1.586563 -1.832815 -0.828932
C -1.471825 -1.599405 1.586752
C -1.316882 -3.214708 -0.724741
C -1.187926 -2.974764 1.708654
C 3.602955 0.407907 0.751652
C 2.441168 -0.837627 -1.012544
C -1.112734 -3.784493 0.553049
C 4.822544 -0.186854 0.369421
C 3.663553 -1.435200 -1.389993
C 4.856812 -1.106392 -0.706240
H -0.863030 3.120747 1.923326
H -1.837929 4.474653 1.249055
H -2.623691 2.914126 1.644372
H 0.125366 3.273197 -1.740182
H 0.723535 3.464544 -0.054817
H -0.362969 4.687516 -0.768253
H -3.509819 2.653253 -0.774839
H -2.789552 4.240863 -1.186695
H -2.375419 2.791071 -2.157035
H 0.322175 0.626887 -1.427654
H -1.542171 -0.964310 2.475779
H -1.271824 -3.839700 -1.621250
H -1.031082 -3.412159 2.699863
H 3.549225 1.108046 1.591678
H 1.520071 -1.141499 -1.524548
H -0.902351 -4.856056 0.635875
H 5.743522 0.061097 0.907989
H 3.683013 -2.163736 -2.207689
H 5.803882 -1.571034 -1.002053


