%chk=000299361.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299361

0 1
O 1.105297 0.139449 -0.078537
O -0.181435 -0.559084 -1.800828
O -0.674837 0.410262 1.606414
N 5.099895 -1.106973 -0.312563
C 3.409464 0.733797 -0.197376
C 2.349932 -0.209114 -0.800549
C 4.780180 0.282794 -0.755973
C 3.457572 0.722873 1.342829
C 2.615321 -1.696351 -0.572650
C 4.085641 -2.059433 -0.858355
C 3.980426 -0.594142 1.933418
C 5.204800 -1.144901 1.178780
C -0.092078 -0.113884 -0.682221
C -1.225249 0.320258 0.286225
C -2.323201 -0.726621 0.372726
C -1.778331 1.670730 -0.148479
C -2.838939 -1.317013 -0.789473
C -2.118267 2.610514 0.834037
C -2.841148 -1.077546 1.627343
C -1.983073 1.967739 -1.502530
C -3.870176 -2.254543 -0.692884
C -2.645906 3.849537 0.461661
C -3.871883 -2.016922 1.716972
C -2.512084 3.207949 -1.869651
C -4.388606 -2.604808 0.558227
C -2.841671 4.150480 -0.890051
H 3.183811 1.773823 -0.531345
H 2.177147 0.014813 -1.876944
H 4.797187 0.319555 -1.864599
H 5.584892 0.963481 -0.407947
H 2.442919 0.923615 1.740097
H 4.096606 1.561062 1.682097
H 1.939936 -2.304224 -1.205021
H 2.357492 -1.954014 0.478952
H 4.303501 -3.073835 -0.462113
H 4.253772 -2.112237 -1.957671
H 4.234543 -0.450768 2.999545
H 3.165114 -1.349545 1.914247
H 6.112385 -0.560684 1.449657
H 5.404034 -2.191870 1.489850
H 0.171641 0.925771 1.598223
H -2.429024 -1.056849 -1.768929
H -1.975663 2.363457 1.888299
H -2.430720 -0.618098 2.529893
H -1.734155 1.234720 -2.273782
H -4.269086 -2.713275 -1.596114
H -2.908905 4.578638 1.226331
H -4.272026 -2.289491 2.691874
H -2.669707 3.438146 -2.922382
H -5.192797 -3.334903 0.629466
H -3.253739 5.115764 -1.179494


%chk=000299361-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299361

0 1
O 1.036668 0.070638 0.133753
O -0.278315 -0.727861 -1.618526
O -0.902518 0.446983 1.782399
N 5.111457 -1.121621 -0.370754
C 3.401612 0.685420 -0.192429
C 2.302048 -0.315365 -0.600687
C 4.709727 0.206022 -0.895370
C 3.685973 0.828940 1.331046
C 2.622589 -1.794368 -0.307126
C 4.093605 -2.140959 -0.728342
C 4.356268 -0.412394 1.983637
C 5.464176 -1.026931 1.072570
C -0.178920 -0.202721 -0.489616
C -1.356129 0.306905 0.396169
C -2.503997 -0.726577 0.392513
C -1.822818 1.687614 -0.147127
C -3.278938 -0.942974 -0.773137
C -2.359450 2.613928 0.781942
C -2.778167 -1.479431 1.559200
C -1.765144 2.038363 -1.518830
C -4.312485 -1.904323 -0.771681
C -2.831310 3.870483 0.346200
C -3.818411 -2.436574 1.559737
C -2.234607 3.299894 -1.951421
C -4.587908 -2.654983 0.394958
C -2.770430 4.220091 -1.023194
H 3.107670 1.680483 -0.581863
H 2.081892 -0.192304 -1.679740
H 4.570839 0.131257 -1.991619
H 5.524511 0.930229 -0.707290
H 2.754735 1.083076 1.870652
H 4.361743 1.701183 1.447973
H 1.916416 -2.440612 -0.860356
H 2.475136 -1.992968 0.767319
H 4.384621 -3.108747 -0.281646
H 4.129881 -2.266113 -1.828859
H 4.808301 -0.117506 2.951248
H 3.595088 -1.176580 2.221813
H 6.374788 -0.397829 1.135716
H 5.741448 -2.035200 1.432124
H 0.048078 0.733862 1.751995
H -3.079223 -0.366952 -1.681205
H -2.392875 2.336992 1.839824
H -2.178246 -1.298806 2.454298
H -1.353268 1.336362 -2.252279
H -4.903626 -2.064974 -1.680248
H -3.246502 4.576399 1.074597
H -4.025739 -3.010558 2.470212
H -2.181028 3.560761 -3.014501
H -5.393330 -3.398280 0.395485
H -3.135084 5.196726 -1.360828


