%chk=000292013.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292013

0 1
O 6.660120 -0.109294 -0.836152
O -7.392305 -0.423019 0.539444
O -5.819783 1.806851 0.624172
O -6.101654 -2.966156 -0.072165
O 0.759168 2.209035 -0.217666
N 0.352681 -0.081765 -0.287551
N -0.995379 0.079656 -0.144260
C 8.830741 -0.881413 -0.460782
C 9.816392 -1.642233 0.433722
C 7.433229 -0.868978 0.151869
C 11.216979 -1.659269 -0.172340
C 5.334191 0.113793 -0.598619
C 2.630326 0.710144 -0.392650
C -3.234836 -0.778578 -0.016855
C 4.617058 -0.346727 0.516767
C 4.715373 0.878903 -1.615485
C -6.030424 -0.504603 0.290340
C -5.168367 0.620139 0.388692
C -5.453218 -1.765215 0.038680
C 3.258642 -0.037283 0.609129
C 3.367216 1.178451 -1.498868
C -3.786671 0.488974 0.231474
C -4.057369 -1.904458 -0.110952
C 1.189307 1.085282 -0.284523
C -1.775658 -0.967057 -0.184127
C -8.110181 0.475649 -0.351008
C -5.010300 3.006819 0.738347
C -7.544445 -2.994912 0.087603
H 8.791815 -1.333658 -1.472960
H 9.176017 0.160077 -0.625305
H 9.851990 -1.178503 1.439800
H 9.464945 -2.681913 0.588057
H 7.389903 -0.334411 1.115302
H 6.992265 -1.875417 0.240626
H 11.228593 -2.145350 -1.155121
H 11.919559 -2.203707 0.469578
H 11.614359 -0.645904 -0.305117
H 5.094035 -0.923426 1.301605
H 5.309769 1.223056 -2.459948
H -3.123575 1.351326 0.301875
H -3.656746 -2.897139 -0.299294
H 2.688747 -0.376565 1.476890
H 2.869841 1.782356 -2.262272
H -1.455256 -2.008340 -0.334226
H 0.775013 -1.007792 -0.430760
H -7.776785 1.507111 -0.180624
H -7.965387 0.178279 -1.390922
H -9.145857 0.336818 -0.026119
H -4.317868 2.917836 1.581362
H -4.482112 3.200157 -0.200123
H -5.773309 3.770153 0.933209
H -7.751685 -4.069472 0.042238
H -8.018040 -2.449927 -0.733153
H -7.827467 -2.562284 1.054966


%chk=000292013-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000292013

0 1
O 6.835752 0.238307 -0.708509
O -7.459957 -0.437294 0.561041
O -5.969855 1.879489 0.379770
O -6.027829 -3.041127 0.388154
O 0.763473 2.394533 -0.627734
N 0.335931 0.111629 -0.277031
N -1.027441 0.292236 -0.149617
C 8.969920 -0.848232 -0.363469
C 9.753061 -2.020992 0.272102
C 7.472190 -0.930055 -0.064414
C 11.264755 -1.948007 -0.032166
C 5.451906 0.385908 -0.590042
C 2.652772 0.874587 -0.488512
C -3.234246 -0.675015 0.086409
C 4.602422 -0.511592 0.107245
C 4.904702 1.535859 -1.218937
C -6.068450 -0.512619 0.353269
C -5.258679 0.672461 0.282496
C -5.423125 -1.781214 0.311622
C 3.214304 -0.260070 0.150877
C 3.525308 1.775868 -1.159996
C -3.864386 0.599590 0.139647
C -4.012417 -1.847946 0.179796
C 1.191412 1.218688 -0.464604
C -1.779288 -0.786203 -0.058922
C -8.249048 0.247658 -0.486758
C -5.183674 3.119133 0.391776
C -7.480634 -3.219266 0.545869
H 9.118450 -0.845638 -1.460261
H 9.360084 0.115418 0.016245
H 9.596740 -2.019221 1.370248
H 9.347775 -2.983840 -0.101017
H 7.281479 -0.897621 1.028725
H 7.033456 -1.863184 -0.475882
H 11.451299 -1.981952 -1.121761
H 11.809722 -2.790296 0.431207
H 11.701431 -1.008168 0.354119
H 5.006735 -1.386568 0.623843
H 5.582164 2.219252 -1.739379
H -3.233258 1.488961 0.076301
H -3.554258 -2.841877 0.144695
H 2.584818 -0.941678 0.736310
H 3.089333 2.666515 -1.623569
H -1.357730 -1.812508 -0.088367
H 0.735395 -0.838257 -0.309561
H -7.955276 1.307249 -0.559969
H -8.112648 -0.256111 -1.464133
H -9.296482 0.159812 -0.159193
H -4.473338 3.129663 1.239606
H -4.629020 3.252820 -0.556250
H -5.923114 3.924562 0.511371
H -7.603726 -4.310619 0.634226
H -8.029914 -2.848599 -0.337735
H -7.855399 -2.708331 1.446621


