%chk=000201812.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201812

0 1
O -3.617982 -0.515039 -1.202369
O 3.854164 1.519302 -0.345016
O 0.572022 3.784470 0.995099
N 0.487553 -2.107375 0.272340
C -0.151296 -0.747384 0.068277
C -1.352431 -0.919617 -0.881244
C 0.835447 0.311706 -0.435113
C -0.629673 -0.436541 1.498857
C 1.497029 -2.470025 -0.744830
C 0.973824 -2.139797 1.703549
C 2.050217 -0.012215 -0.919471
C 2.587136 -1.412201 -0.964395
C -2.430170 0.162864 -0.716083
C 0.042780 -1.174482 2.399304
C 0.408441 1.751037 -0.345559
C -1.798902 0.405911 1.700108
C -2.658463 0.637531 0.699022
C 3.032979 1.024619 -1.414925
C 0.921476 2.398273 0.948477
C -4.678192 0.353315 -1.635778
H -1.828075 -1.911792 -0.681717
H -1.019074 -0.967151 -1.932732
H 0.941621 -2.644209 -1.696230
H 1.951107 -3.445145 -0.465801
H 2.036724 -1.853190 1.827223
H 0.850692 -3.176585 2.079892
H 3.097726 -1.605103 -1.929651
H 3.382261 -1.502125 -0.191353
H -2.217245 1.043158 -1.369161
H -0.059722 -1.177946 3.469318
H -0.694491 1.861131 -0.386139
H 0.771648 2.322948 -1.226117
H -1.966959 0.784440 2.709202
H -3.582442 1.193008 0.850129
H 2.530376 1.885302 -1.899148
H 3.780959 0.609636 -2.118755
H 2.023930 2.293631 1.055545
H 0.422995 1.987604 1.848798
H -5.060276 0.948435 -0.801886
H -5.440299 -0.358110 -1.979783
H -4.345204 0.990450 -2.459809
H 3.285505 1.797002 0.419102
H 0.990183 4.276660 0.262423


%chk=000201812-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201812

0 1
O -3.674795 -0.552326 -1.378834
O 4.228101 1.078190 -0.539626
O 0.492139 3.853332 1.165783
N 0.556413 -2.062438 0.386456
C -0.175521 -0.781643 0.120072
C -1.383567 -1.019412 -0.834691
C 0.791082 0.331869 -0.403475
C -0.691974 -0.468733 1.536950
C 1.456824 -2.487453 -0.697326
C 1.119753 -1.969954 1.765521
C 2.016772 -0.002289 -0.930873
C 2.536080 -1.432407 -1.038638
C -2.477316 0.068049 -0.756950
C 0.092166 -1.095302 2.462353
C 0.352728 1.792643 -0.255905
C -1.939160 0.262623 1.719144
C -2.775506 0.514472 0.665227
C 3.021605 1.032890 -1.409612
C 1.019483 2.498710 0.953978
C -4.672465 0.419239 -1.825885
H -1.851095 -1.970651 -0.522058
H -1.054602 -1.128018 -1.883234
H 0.832882 -2.681660 -1.590365
H 1.922293 -3.450739 -0.417814
H 2.139332 -1.507063 1.811808
H 1.197714 -2.977347 2.219372
H 2.918457 -1.605709 -2.065715
H 3.422325 -1.529529 -0.379291
H -2.201926 0.952915 -1.379187
H -0.032313 -1.057059 3.548253
H -0.733028 1.867707 -0.093475
H 0.576767 2.372941 -1.173584
H -2.225914 0.562546 2.735274
H -3.722297 1.043692 0.831866
H 2.582715 2.043771 -1.500283
H 3.438024 0.744731 -2.390815
H 2.124485 2.527428 0.830498
H 0.785608 1.961230 1.886173
H -5.151924 0.955343 -0.980666
H -5.440434 -0.161105 -2.361500
H -4.226613 1.167564 -2.516350
H 3.926836 1.254053 0.389569
H 0.677765 4.401299 0.361457


