%chk=000230111.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230111

0 1
O -7.570477 0.058739 -0.000408
O -6.770966 2.067484 -0.000439
O 3.394725 1.325240 -0.000280
O 8.370570 1.593986 0.000196
O 8.172012 -0.640503 0.000066
N 2.944938 -0.940401 0.000203
N -6.642456 0.853149 -0.000257
C -1.578288 1.382874 -0.000215
C -0.584974 0.244283 -0.000030
C -2.909694 0.671370 -0.000138
C -1.269411 -1.010208 0.000136
C -2.710220 -0.750246 0.000068
C 0.796470 0.310426 -0.000013
C -4.181288 1.206710 -0.000246
C -0.550627 -2.200266 0.000318
C -3.793663 -1.620302 0.000169
C 1.514471 -0.905102 0.000172
C 0.847274 -2.149341 0.000337
C -5.270474 0.305857 -0.000145
C -5.088698 -1.082507 0.000065
C 3.802424 0.181179 -0.000008
C 5.257689 -0.181090 0.000071
C 6.184606 0.779849 -0.000148
C 7.629247 0.439539 -0.000106
H -1.455505 2.037616 0.886010
H -1.455471 2.037358 -0.886627
H 1.318025 1.273457 -0.000144
H -4.363330 2.285153 -0.000400
H -1.063498 -3.161703 0.000445
H -3.647595 -2.698847 0.000324
H 1.409668 -3.080237 0.000477
H -5.963084 -1.743322 0.000136
H 3.361132 -1.876173 0.000395
H 5.527513 -1.242737 0.000295
H 5.940651 1.853654 -0.000383
H 9.353403 1.419765 0.000402


%chk=000230111-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230111

0 1
O -7.690657 -0.102225 -0.000101
O -6.902095 2.040123 -0.000538
O 3.483131 1.481794 -0.000136
O 8.555974 1.450495 -0.000148
O 8.132719 -0.840977 0.000272
N 2.961108 -0.818625 0.000168
N -6.724478 0.758183 -0.000258
C -1.640539 1.430170 -0.000286
C -0.612779 0.305905 -0.000087
C -2.965355 0.679313 -0.000195
C -1.275919 -0.960057 0.000099
C -2.726135 -0.733981 0.000037
C 0.785339 0.403653 -0.000073
C -4.270793 1.184213 -0.000307
C -0.518701 -2.154920 0.000304
C -3.807260 -1.647765 0.000166
C 1.542689 -0.803379 0.000134
C 0.883869 -2.070205 0.000320
C -5.335037 0.248743 -0.000168
C -5.124752 -1.151537 0.000064
C 3.849127 0.266242 0.000010
C 5.281711 -0.153163 0.000186
C 6.284941 0.766958 0.000138
C 7.702753 0.339147 0.000340
H -1.535691 2.085093 0.886254
H -1.535652 2.084811 -0.887030
H 1.305916 1.362917 -0.000213
H -4.496469 2.253835 -0.000482
H -1.005788 -3.135477 0.000450
H -3.631676 -2.728330 0.000346
H 1.483164 -2.989550 0.000478
H -5.992485 -1.815923 0.000163
H 3.388998 -1.748435 0.000336
H 5.542209 -1.221328 0.000370
H 6.061566 1.838652 -0.000042
H 9.502148 1.140332 -0.000274


