%chk=000232189.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232189

0 1
O -2.621481 0.562482 -1.593244
O -1.768397 2.220437 -0.317889
N 2.435266 0.633295 0.974881
N 2.197154 -1.808287 0.872355
N 0.935193 -2.841120 -0.807170
N 3.689117 -0.786804 2.399961
C -0.421999 1.193159 -2.128420
C 0.666109 2.251124 -1.889685
C 0.135834 -0.230247 -1.927037
C 1.239319 2.158646 -0.474088
C 1.011933 -0.369279 -0.721585
C 1.576099 0.750517 -0.077513
C -1.613464 1.426804 -1.213808
C 1.363312 -1.651214 -0.210481
C -3.872457 0.589128 -0.839694
C 2.740633 -0.650192 1.396729
C -3.696859 -0.202383 0.452268
C -5.039046 -0.399140 1.166806
C -4.870622 -1.180658 2.467242
H -0.793999 1.279742 -3.183513
H 0.257374 3.267436 -2.057221
H 1.474013 2.110516 -2.635797
H 0.724910 -0.511312 -2.828573
H -0.716729 -0.942807 -1.879751
H 0.494664 2.557744 0.261636
H 2.128349 2.816863 -0.368284
H -4.564210 0.112428 -1.556361
H -4.157629 1.640326 -0.658978
H -2.982017 0.328012 1.116885
H -3.226961 -1.180587 0.233416
H -5.749527 -0.929090 0.502210
H -5.498313 0.586577 1.382663
H 1.122721 -3.702070 -0.306148
H 0.064534 -2.832038 -1.314999
H -4.453038 -2.178296 2.290470
H -4.198929 -0.664369 3.163912
H -5.831644 -1.312302 2.977512
H 3.945555 0.030564 2.933728
H 3.788932 -1.682506 2.852764


%chk=000232189-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000232189

0 1
O -2.516712 0.300396 -1.596475
O -1.972506 2.386572 -0.714885
N 2.213832 0.563149 1.121344
N 2.158475 -1.859986 0.780233
N 1.106567 -2.810814 -1.064727
N 3.223983 -0.910433 2.635899
C -0.376164 1.231456 -2.232468
C 0.663046 2.314914 -1.859196
C 0.247558 -0.185558 -2.103527
C 1.153628 2.158502 -0.403910
C 1.047616 -0.361998 -0.822703
C 1.485142 0.725667 -0.030922
C -1.663880 1.394172 -1.414764
C 1.437887 -1.664774 -0.364343
C -3.811624 0.327967 -0.847801
C 2.505024 -0.728782 1.472556
C -3.642415 -0.271523 0.554104
C -4.986845 -0.327458 1.318407
C -4.833166 -0.942446 2.726122
H -0.684154 1.366066 -3.290360
H 0.228902 3.320990 -1.995620
H 1.516856 2.219774 -2.558063
H 0.902967 -0.352745 -2.984980
H -0.569528 -0.930171 -2.164983
H 0.376247 2.529148 0.290896
H 2.049395 2.778832 -0.221398
H -4.490630 -0.275898 -1.472949
H -4.167177 1.373010 -0.794210
H -2.916171 0.337509 1.124613
H -3.219281 -1.291240 0.467296
H -5.721999 -0.918522 0.734505
H -5.403824 0.696109 1.406025
H 1.409666 -3.703681 -0.682430
H 0.569879 -2.779126 -1.925110
H -4.440640 -1.974999 2.667114
H -4.129550 -0.351125 3.340975
H -5.801510 -0.977311 3.257804
H 3.497492 -0.093133 3.173294
H 3.467316 -1.851410 2.929836


