%chk=000290773.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290773

0 1
O -1.990964 3.170065 1.183485
O 1.794212 -1.724967 -1.211212
O -1.444167 3.702285 3.292549
O 3.926154 -0.518836 1.803855
O 2.525846 1.479102 -2.129150
O -1.445092 -3.226541 1.578912
O -0.864066 -5.075815 0.454112
O -6.532942 -2.068845 -0.993598
O -7.515827 -0.845995 0.496785
N -0.661128 1.235301 0.805536
N 2.899301 0.471038 -0.046643
N -0.206411 -1.592182 -0.130650
N -6.561238 -1.140720 -0.202095
C 0.602977 1.363649 0.020409
C 1.509781 0.150004 0.328415
C -1.782028 2.070364 0.248999
C -0.521210 1.647014 2.233803
C -3.042034 1.231525 0.156741
C 1.074984 -1.134691 -0.426075
C -1.318359 2.932317 2.389559
C 4.033149 -0.026348 0.713520
C 3.294557 0.999138 -1.339142
C 5.224455 0.271696 -0.142987
C 4.787966 0.872123 -1.358665
C -3.073800 0.166196 -0.757593
C -4.162386 1.529200 0.942603
C 6.560743 0.036214 0.098203
C 5.686678 1.237010 -2.337502
C -4.224449 -0.610877 -0.878446
C -5.319414 0.757003 0.828631
C -0.661117 -2.890325 -0.647809
C -5.339257 -0.311009 -0.079679
C 7.486072 0.410730 -0.906064
C 7.060279 0.995051 -2.092670
C -0.962589 -3.876094 0.464655
H 0.372890 1.384336 -1.073925
H 1.156039 2.309698 0.224441
H 1.502951 -0.085669 1.434168
H -1.552144 2.575011 -0.720694
H 0.530409 1.777996 2.566787
H -0.959345 0.842011 2.872792
H -2.199313 -0.057068 -1.372328
H -4.132609 2.376018 1.636464
H -0.820522 -1.126978 0.545120
H 6.899948 -0.425943 1.026735
H 5.357103 1.693064 -3.272517
H -4.272051 -1.445650 -1.586423
H -6.205373 0.976022 1.436309
H 0.122780 -3.335699 -1.326537
H -1.581182 -2.762223 -1.270193
H 8.549460 0.229994 -0.736633
H 7.788740 1.273419 -2.856905
H -1.655161 -3.853221 2.325046


%chk=000290773-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290773

0 1
O -1.731939 2.857425 1.422227
O 2.284456 -2.202062 -0.539115
O -1.242958 2.879920 3.705904
O 4.258324 0.193571 1.959852
O 2.497030 0.683206 -2.376456
O -1.769593 -2.722348 1.590252
O -2.022266 -4.704760 0.403858
O -6.951104 -1.658049 -1.268119
O -7.880990 -0.226792 0.246365
N -0.615439 0.843976 0.786202
N 3.063421 0.408431 -0.081953
N 0.045139 -1.695397 -0.106474
N -6.878146 -0.683971 -0.424637
C 0.733357 1.154596 0.210721
C 1.757211 0.004343 0.433224
C -1.674407 1.797693 0.355991
C -0.679756 0.884601 2.277342
C -3.048360 1.148449 0.192287
C 1.388038 -1.399289 -0.148439
C -1.219840 2.287387 2.622382
C 4.247849 0.392102 0.721358
C 3.355581 0.631392 -1.460550
C 5.372726 0.668110 -0.222917
C 4.839121 0.808664 -1.528296
C -3.185984 0.071433 -0.721367
C -4.184626 1.630167 0.885433
C 6.749144 0.783308 0.022110
C 5.664552 1.069025 -2.631837
C -4.437597 -0.534686 -0.931552
C -5.445190 1.028171 0.692674
C -0.439532 -3.028292 -0.437742
C -5.551093 -0.047407 -0.212226
C 7.593007 1.044732 -1.088634
C 7.059021 1.185029 -2.394962
C -1.468868 -3.594602 0.530549
H 0.612398 1.304469 -0.875590
H 1.167261 2.081789 0.644766
H 1.920558 -0.149929 1.520859
H -1.370796 2.312098 -0.571265
H 0.303763 0.727163 2.744992
H -1.370683 0.113576 2.664270
H -2.311853 -0.287979 -1.276063
H -4.081565 2.480339 1.564868
H -0.588456 -0.946810 0.241702
H 7.150373 0.670495 1.033945
H 5.242591 1.171701 -3.636293
H -4.570187 -1.363729 -1.631525
H -6.336288 1.378278 1.220099
H 0.429974 -3.712558 -0.473072
H -0.896019 -3.073379 -1.447502
H 8.673677 1.137544 -0.937768
H 7.735754 1.383311 -3.232815
H -2.449500 -3.155557 2.175437


