%chk=000179491.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179491

0 1
O -0.568205 -2.209596 -0.732920
O -2.136340 -1.319330 0.759340
O 1.740051 -3.453383 -0.393303
O -4.618808 0.107301 0.373461
N 2.624696 2.899137 0.159377
C 1.337338 2.157174 0.342759
C 1.524730 0.658449 0.195376
C 0.337412 2.639975 -0.736335
C 2.781776 0.063267 0.276131
C 0.353262 -0.111312 -0.055682
C 4.022787 0.889410 0.468167
C -0.972304 1.930223 -0.538711
C 3.717927 2.304819 0.984727
C -0.947546 0.575281 -0.114462
C 0.508817 -1.478603 -0.306314
C 2.919003 -1.334804 0.116350
C -2.164563 -0.029318 0.249218
C 1.795801 -2.086092 -0.179502
C -2.181813 2.605419 -0.714300
C -3.385938 0.656228 0.030522
C -3.397359 1.962393 -0.458333
C -2.728057 -1.439953 2.084643
C 2.984728 -4.187456 -0.322543
C -4.961449 -1.077670 -0.399197
H 0.894305 2.345671 1.360582
H 0.746216 2.420337 -1.748099
H 0.219322 3.737951 -0.697199
H 2.492392 3.883894 0.414932
H 4.731281 0.387745 1.154860
H 4.538260 0.965196 -0.516540
H 3.474652 2.265688 2.069118
H 4.617887 2.947898 0.873808
H 3.898732 -1.792162 0.205263
H -2.186406 3.638481 -1.056852
H -4.348500 2.467340 -0.618224
H -0.366453 -3.185425 -0.711297
H -2.699209 -2.522080 2.246526
H -3.754495 -1.055966 2.095552
H -2.098118 -0.913046 2.805812
H 2.653141 -5.212164 -0.533832
H 3.412689 -4.110008 0.681157
H 3.677572 -3.831328 -1.090850
H -5.889037 -1.406865 0.078705
H -4.170051 -1.832599 -0.316322
H -5.127226 -0.792117 -1.441171


%chk=000179491-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179491

0 1
O -0.544602 -2.265918 -0.922238
O -2.210698 -1.255584 0.927931
O 1.762932 -3.493792 -0.584690
O -4.686283 0.086611 0.321063
N 2.625976 2.842479 0.229356
C 1.325118 2.150278 0.326852
C 1.509099 0.636604 0.209104
C 0.369821 2.603738 -0.805393
C 2.782110 0.036267 0.309453
C 0.335812 -0.136590 -0.081360
C 4.023518 0.869826 0.606699
C -0.975618 1.922938 -0.614196
C 3.650700 2.269959 1.128696
C -0.972902 0.563322 -0.164594
C 0.499653 -1.505960 -0.396363
C 2.908726 -1.364035 0.099533
C -2.207511 -0.018503 0.241582
C 1.783846 -2.113300 -0.268582
C -2.193634 2.614560 -0.779224
C -3.435031 0.663196 -0.009198
C -3.426140 1.974648 -0.521373
C -2.707601 -1.153774 2.320981
C 3.028381 -4.220956 -0.519339
C -4.970908 -1.197316 -0.362992
H 0.814548 2.366275 1.303689
H 0.841058 2.337324 -1.772118
H 0.245704 3.703380 -0.787631
H 2.520733 3.859511 0.334500
H 4.667405 0.349778 1.343598
H 4.617001 0.989160 -0.321350
H 3.293889 2.187916 2.186202
H 4.538553 2.927796 1.125475
H 3.893780 -1.833812 0.193269
H -2.180484 3.656235 -1.119455
H -4.384341 2.478725 -0.681430
H -0.214608 -3.197418 -1.036930
H -2.662728 -2.179777 2.718080
H -3.744906 -0.773436 2.346274
H -2.047579 -0.492154 2.913771
H 2.789489 -5.256609 -0.802971
H 3.444549 -4.200118 0.506388
H 3.766085 -3.798014 -1.228411
H -5.942831 -1.530064 0.033136
H -4.183807 -1.941037 -0.146409
H -5.043372 -1.034358 -1.454988


