%chk=000185402.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185402

0 1
O 6.129586 0.470241 -0.067878
O 5.473961 -1.794401 0.215567
O -5.935573 -1.516860 0.069776
O -4.943008 1.135364 0.799630
N -0.610123 1.220602 0.501161
C 0.499757 2.184860 0.624976
C -0.460114 -0.145253 0.047377
C 1.448124 2.073713 -0.580378
C 2.458679 0.983514 -0.367970
C -1.845645 -0.676682 -0.006886
C 2.060694 -0.353875 -0.202277
C -2.732234 0.420344 0.400606
C 0.674603 -0.808143 -0.250377
C -1.957305 1.530565 0.678805
C 3.828610 1.364931 -0.336919
C 3.036692 -1.380395 0.002039
C 4.747085 0.365291 -0.138761
C 4.351808 -0.996811 0.030938
C -2.325125 -1.897116 -0.341013
C -4.168644 0.251710 0.467169
C -4.619757 -1.136309 0.079039
C -3.752230 -2.120957 -0.293233
C 6.626757 -0.891091 0.156815
C -6.945851 -0.544992 0.453086
H 1.054427 1.977417 1.572969
H 0.090720 3.216243 0.706425
H 1.942104 3.052585 -0.749640
H 0.875248 1.877316 -1.514949
H 0.561814 -1.857247 -0.560657
H -2.288960 2.511882 1.002310
H 4.131223 2.400251 -0.466743
H 2.740346 -2.418046 0.135190
H -1.686471 -2.722541 -0.645067
H -4.130681 -3.106633 -0.563996
H 7.120998 -0.911241 1.136913
H 7.233756 -1.175376 -0.712734
H -7.863503 -1.133894 0.348424
H -6.926459 0.311064 -0.229000
H -6.783607 -0.216134 1.484563


%chk=000185402-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185402

0 1
O 6.253990 0.430942 -0.162172
O 5.570551 -1.868265 0.021262
O -6.001867 -1.537106 0.080145
O -5.032547 1.238687 0.634042
N -0.664282 1.277913 0.411656
C 0.427129 2.233023 0.657539
C -0.487184 -0.108264 0.100618
C 1.522352 2.158834 -0.435577
C 2.527118 1.034167 -0.250435
C -1.843228 -0.668667 0.054819
C 2.101961 -0.336311 -0.113437
C -2.772764 0.408689 0.344072
C 0.715303 -0.779630 -0.080489
C -2.009427 1.563313 0.554876
C 3.910010 1.363366 -0.263704
C 3.099026 -1.375519 -0.031304
C 4.843862 0.330513 -0.160636
C 4.439142 -1.016967 -0.053541
C -2.335813 -1.947745 -0.214431
C -4.227812 0.259185 0.381336
C -4.669706 -1.133512 0.096548
C -3.747268 -2.156832 -0.184671
C 6.752684 -0.968340 -0.034353
C -7.115455 -0.605194 0.360643
H 0.876365 2.045501 1.651814
H -0.021645 3.241791 0.672472
H 2.060629 3.123564 -0.443937
H 1.015176 2.068773 -1.417288
H 0.585116 -1.862692 -0.204772
H -2.355404 2.567156 0.799468
H 4.236232 2.402214 -0.366887
H 2.798882 -2.423276 0.059700
H -1.674657 -2.789257 -0.446933
H -4.157303 -3.152104 -0.386495
H 7.320604 -1.059650 0.907366
H 7.352582 -1.215109 -0.926704
H -8.011830 -1.239396 0.268804
H -7.136346 0.220526 -0.367642
H -7.032474 -0.180426 1.373526


