%chk=000192962.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192962

0 1
O -0.815012 0.110155 -1.854635
N -2.803766 0.515952 0.207801
C -0.486227 0.667203 -0.567377
C -1.418009 0.060643 0.513118
C -3.862470 -0.478279 0.594706
C 0.956760 0.310729 -0.294888
C -4.090769 -1.414369 -0.600374
C -5.153120 0.263613 0.967388
C 1.675022 1.021271 0.677210
C 1.584680 -0.722180 -1.003476
C 3.636536 -0.341233 0.236523
C 3.005658 0.695089 0.944183
C 2.916234 -1.046952 -0.740288
C 5.057680 -0.698623 0.530888
H -0.622426 1.770659 -0.648800
H -1.069208 0.344858 1.526246
H -1.347217 -1.048424 0.454718
H -3.539930 -1.094052 1.476388
H -2.976712 1.426714 0.641508
H -4.845298 -2.173372 -0.375115
H -4.427593 -0.856437 -1.482830
H -3.166583 -1.930534 -0.886460
H -5.031473 0.879632 1.863738
H -5.967009 -0.443390 1.165264
H -5.490673 0.919011 0.154163
H 1.200326 1.832671 1.225556
H 1.020958 -1.259191 -1.771299
H 3.555466 1.249435 1.701141
H 3.395566 -1.848741 -1.297659
H -1.797577 0.123556 -1.966864
H 5.109367 -1.477355 1.306001
H 5.580105 -1.086478 -0.353866
H 5.637815 0.160120 0.893290


%chk=000192962-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000192962

0 1
O -1.025642 0.645466 -1.705972
N -2.851816 0.569828 0.245244
C -0.499381 0.997745 -0.392441
C -1.447140 0.353222 0.675219
C -3.853439 -0.478148 0.614953
C 0.931900 0.510421 -0.234881
C -3.677872 -1.729816 -0.271671
C -5.266279 0.118646 0.456530
C 1.768018 1.058021 0.768963
C 1.442933 -0.521159 -1.057703
C 3.597517 -0.470286 0.144151
C 3.080869 0.572108 0.956476
C 2.757802 -1.000145 -0.869696
C 5.001655 -1.009821 0.361725
H -0.525213 2.104749 -0.257730
H -1.220962 0.754724 1.686163
H -1.253758 -0.733296 0.694774
H -3.719563 -0.781838 1.680817
H -3.187586 1.508835 0.502238
H -4.385257 -2.521149 0.037272
H -3.869832 -1.475692 -1.329851
H -2.656695 -2.144552 -0.202208
H -5.416625 0.986191 1.127747
H -6.036206 -0.633840 0.700837
H -5.425553 0.452323 -0.585534
H 1.400410 1.879488 1.398253
H 0.803598 -0.911937 -1.855012
H 3.716253 1.012454 1.735232
H 3.143256 -1.791882 -1.524719
H -2.020091 0.583109 -1.532356
H 4.997073 -1.862412 1.068989
H 5.447108 -1.370667 -0.582395
H 5.671620 -0.238990 0.782485


